data_2n41_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 2n41 _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 ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.242 0.692 0 CA-C-O 120.933 0.397 . . . . 75.409999999999997 110.766 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.47 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 71.019999999999996 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 73.219999999999999 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.019999999999996 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 73.120000000000005 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.450000000000003 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 75.400000000000006 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.430000000000007 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p . . . . . 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 75.129999999999995 109.235 177.891 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 65.209999999999994 108.561 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.400000000000006 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.209999999999994 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.219999999999999 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.140000000000001 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 64.420000000000002 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.442 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 75.219999999999999 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 75.099999999999994 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.299999999999997 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.442 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.430000000000007 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.409999999999997 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.310000000000002 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.319999999999993 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.129999999999995 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.425 ' HB3' HG22 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.450000000000003 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.120000000000005 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.129999999999995 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.409999999999997 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 72.310000000000002 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 72.120000000000005 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.239999999999995 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.140000000000001 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 75.219999999999999 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 75.019999999999996 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.349999999999994 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 62.520000000000003 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.25 109.83 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.319999999999993 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.299999999999997 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.310000000000002 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.429 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 74.540000000000006 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.426 ' HB ' HD22 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.420000000000002 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.219999999999999 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.450000000000003 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.200000000000003 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HB2' HG22 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.430000000000007 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.209999999999994 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.340000000000003 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.540000000000006 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.319999999999993 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 73.140000000000001 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.400000000000006 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.340000000000003 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.434 ' HZ2' ' HB2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.329999999999998 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.477 ' HB3' HG23 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.340000000000003 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 62.030000000000001 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.310000000000002 110.465 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.426 HD22 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 74.319999999999993 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 74.239999999999995 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.409999999999997 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.57 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 72.510000000000005 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.310000000000002 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 74.439999999999998 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 64.129999999999995 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.209999999999994 109.256 177.729 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 75.329999999999998 108.984 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 72.519999999999996 110.554 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.239999999999995 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 75.439999999999998 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.400000000000006 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.009999999999998 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 74.349999999999994 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.451 HG22 ' HB2' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 53.030000000000001 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 73.409999999999997 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.129999999999995 109.846 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.129999999999995 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 65.120000000000005 114.033 176.52 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 121.114 0.483 . . . . 74.340000000000003 110.609 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.548 HG22 HD23 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 71.219999999999999 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.420000000000002 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.200000000000003 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.549999999999997 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 73.030000000000001 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 63.140000000000001 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 73.209999999999994 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 70.5 108.257 -175.977 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.510000000000005 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.109999999999999 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.472 ' HH ' ' HE2' ' A' ' 47' ' ' TYR . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 74.120000000000005 109.573 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.420000000000002 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.469 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.420000000000002 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.329999999999998 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.503 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.099999999999994 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.474 ' HG2' HE21 ' A' ' 38' ' ' GLN . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.030000000000001 111.634 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.420000000000002 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.503 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 63.229999999999997 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.548 HD23 HG22 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 74.5 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.474 HE21 ' HG2' ' A' ' 34' ' ' GLU . 71.9 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.209999999999994 111.713 -177.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.200000000000003 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 74.120000000000005 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.329999999999998 112.51 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.420000000000002 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 74.349999999999994 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.549999999999997 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.450000000000003 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 63.530000000000001 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.472 ' HE2' ' HH ' ' A' ' 29' ' ' TYR . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.430000000000007 111.061 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 72.219999999999999 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.129999999999995 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 74.430000000000007 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 52.009999999999998 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.010000000000005 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.140000000000001 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.409999999999997 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.450000000000003 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.549999999999997 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 75.310000000000002 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 72.519999999999996 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 74.420000000000002 109.767 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.140000000000001 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 71' ' ' PHE . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 63.549999999999997 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.42 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.450000000000003 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.402 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 71.319999999999993 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.030000000000001 115.113 -168.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.549999999999997 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.329999999999998 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.420000000000002 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.129999999999995 111.389 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 74.230000000000004 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.539 ' HD2' ' HB1' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.450000000000003 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.239999999999995 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.350000000000001 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.549999999999997 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 72.510000000000005 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 71.519999999999996 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.230000000000004 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 64.430000000000007 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.019999999999996 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.299999999999997 111.602 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 73.439999999999998 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 72.340000000000003 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.450000000000003 113.183 -174.333 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.053 -0.351 . . . . 73.530000000000001 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.209999999999994 110.536 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 72.120000000000005 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.319999999999993 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 74.239999999999995 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 64.310000000000002 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 75.030000000000001 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.140000000000001 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 74.340000000000003 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.230000000000004 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 72.340000000000003 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.430000000000007 113.428 177.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.063 0.458 . . . . 75.519999999999996 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.434 HG23 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 62.149999999999999 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 75.25 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 74.310000000000002 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.450000000000003 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.65 HD22 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.420000000000002 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.030000000000001 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.439999999999998 108.999 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.530000000000001 109.813 179.062 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.525 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 109.708 -0.478 . . . . 72.430000000000007 109.708 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.239999999999995 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 75.409999999999997 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 71.430000000000007 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 73.519999999999996 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.140000000000001 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.597 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.200000000000003 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.219999999999999 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.100000000000001 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.597 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 70.310000000000002 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.434 HD22 HG23 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 72.430000000000007 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.439999999999998 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.25 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 74.400000000000006 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.120000000000005 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 63.329999999999998 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.439999999999998 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 74.140000000000001 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 74.519999999999996 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.109999999999999 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 72.140000000000001 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.537 HD11 ' HG ' ' A' ' 56' ' ' SER . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.019999999999996 110.252 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 73.140000000000001 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 72.109999999999999 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 64.439999999999998 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 64.310000000000002 111.011 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.439999999999998 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 74.430000000000007 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.439999999999998 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.65 ' HB2' HD22 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.140000000000001 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.471 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.420000000000002 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.540000000000006 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG22 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 HD13 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.209999999999994 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.239999999999995 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.430000000000007 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 74.430000000000007 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 74.510000000000005 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.540000000000006 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.140000000000001 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.420000000000002 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.219999999999999 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.409999999999997 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HZ2' ' HB2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.450000000000003 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 52.350000000000001 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.430000000000007 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.200000000000003 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.409999999999997 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 74.530000000000001 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.411 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 74.120000000000005 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 74.200000000000003 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.435 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 74.549999999999997 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.42 ' HB3' HD11 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.520000000000003 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.239999999999995 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.349999999999994 110.405 171.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.450000000000003 111.579 175.245 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.42 HD11 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.233 -0.284 . . . . 74.519999999999996 110.233 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 75.209999999999994 111.212 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.120000000000005 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 72.200000000000003 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.120000000000005 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.230000000000004 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.310000000000002 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.239999999999995 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 72.310000000000002 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.439999999999998 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.445 HG22 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.549999999999997 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 75.310000000000002 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 72.340000000000003 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 71.219999999999999 114.984 168.481 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.337 -0.246 . . . . 75.430000000000007 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.582 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 73.239999999999995 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.200000000000003 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 36.6 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.430000000000007 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 74.310000000000002 108.56 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.340000000000003 108.307 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.450000000000003 110.062 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p . . . . . 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.340000000000003 108.214 172.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.493 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.669 -0.205 . . . . 75.129999999999995 111.18 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 74.5 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.209999999999994 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.510000000000005 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 73.319999999999993 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.568 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.420000000000002 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 75.200000000000003 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.099999999999994 110.147 172.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.568 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 74.019999999999996 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.491 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 75.230000000000004 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 75.5 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.099999999999994 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.430000000000007 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.445 HD22 HD12 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 74.219999999999999 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.509999999999998 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.239999999999995 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 74.239999999999995 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 74.450000000000003 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 72.510000000000005 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.42 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 64.519999999999996 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 73.340000000000003 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.010000000000005 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.120000000000005 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 3.9 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.219999999999999 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 62.119999999999997 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.340000000000003 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 70.430000000000007 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.230000000000004 109.517 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 72.239999999999995 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.58 ' HB ' HD22 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 62.020000000000003 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.439999999999998 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.491 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.510000000000005 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 74.340000000000003 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 71.510000000000005 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 74.510000000000005 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.549999999999997 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.439999999999998 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 75.519999999999996 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 65.439999999999998 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 74.019999999999996 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 72.109999999999999 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 74.340000000000003 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 73.019999999999996 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.402 ' O ' HD12 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.129999999999995 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 73.140000000000001 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 72.109999999999999 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.58 HD22 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.530000000000001 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.402 HD12 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 74.209999999999994 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.230000000000004 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.513 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.040000000000006 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 73.239999999999995 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 72.310000000000002 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.430000000000007 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 64.109999999999999 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.409999999999997 109.444 -177.399 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.094 -0.336 . . . . 75.219999999999999 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.420000000000002 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 60.119999999999997 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 75.109999999999999 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.230000000000004 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 73.140000000000001 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.140000000000001 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.209999999999994 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.299999999999997 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 75.219999999999999 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 61.149999999999999 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 62.109999999999999 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.200000000000003 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.200000000000003 112.975 176.964 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 C--O 1.241 0.645 0 N-CA-C 109.969 -0.382 . . . . 74.400000000000006 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 74.439999999999998 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 72.319999999999993 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 74.310000000000002 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.433 ' HG2' HG22 ' A' ' 28' ' ' THR . 24.2 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 74.209999999999994 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 23.4 p-10 -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.140000000000001 109.902 -179.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.340000000000003 107.281 163.151 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.673 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 . . . . . 0 CA--C 1.558 1.271 0 CA-C-O 120.956 0.407 . . . . 74.510000000000005 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.340000000000003 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.230000000000004 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.455 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 75.129999999999995 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.310000000000002 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 73.430000000000007 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.400000000000006 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.430000000000007 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.519999999999996 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 73.450000000000003 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 73.420000000000002 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 75.310000000000002 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.340000000000003 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.129999999999995 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.230000000000004 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.010000000000005 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.349999999999994 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.520000000000003 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.420000000000002 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 74.0 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 75.420000000000002 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.420000000000002 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.230000000000004 110.594 176.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 75.150000000000006 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.219999999999999 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 74.140000000000001 110.002 174.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 74.099999999999994 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 73.549999999999997 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.439999999999998 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.400000000000006 110.385 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 74.010000000000005 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.495 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 71.510000000000005 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 71.109999999999999 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB2' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.420000000000002 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.010000000000005 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 72.430000000000007 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.510000000000005 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.549999999999997 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.554 ' HA ' ' HB2' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.150000000000006 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 73.349999999999994 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.51 ' HZ2' ' HB2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.329999999999998 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.495 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.129999999999995 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 45.409999999999997 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.329999999999998 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 74.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.457 HD11 HD21 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.319999999999993 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.541 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.120000000000005 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 75.310000000000002 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.535 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.209999999999994 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 75.120000000000005 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 72.25 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.030000000000001 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.239999999999995 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 70.030000000000001 110.797 177.772 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.541 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 74.510000000000005 109.562 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.209999999999994 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 74.109999999999999 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.439999999999998 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.400000000000006 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.409999999999997 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.129999999999995 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.645 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.209999999999994 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.230000000000004 111.143 -176.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.439 HG23 ' HB1' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 74.540000000000006 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.219999999999999 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 73.030000000000001 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.319999999999993 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 74.219999999999999 111.698 170.071 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 121.135 0.493 . . . . 74.129999999999995 111.987 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.463 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 74.230000000000004 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 64.299999999999997 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 72.319999999999993 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.430000000000007 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.310000000000002 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 64.420000000000002 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.240000000000002 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.478 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p . . . . . 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 65.019999999999996 108.893 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 111.814 0.302 . . . . 63.229999999999997 111.814 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.200000000000003 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 75.530000000000001 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.400000000000006 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.531 HG22 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.329999999999998 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 55.420000000000002 109.638 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 72.420000000000002 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.299999999999997 111.177 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 63.049999999999997 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.531 ' HB2' HG22 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.409999999999997 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.540000000000006 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.140000000000001 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.239999999999995 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 44' ' ' LEU . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 64.310000000000002 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 75.239999999999995 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 72.409999999999997 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 64.129999999999995 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 72.140000000000001 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 72.310000000000002 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 71.519999999999996 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 75.109999999999999 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 75.109999999999999 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 74.129999999999995 111.931 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.140000000000001 112.726 -175.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.329999999999998 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.140000000000001 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 72.209999999999994 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.439999999999998 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 64.299999999999997 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 72.140000000000001 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 74.400000000000006 109.312 177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 75.120000000000005 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 75.340000000000003 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.463 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.329999999999998 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.230000000000004 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 74.420000000000002 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.129999999999995 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 75.239999999999995 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 72.099999999999994 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.349999999999994 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.310000000000002 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.299999999999997 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 74.239999999999995 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.420000000000002 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' HD11 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 72.150000000000006 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 65.340000000000003 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.150000000000006 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.340000000000003 111.496 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.511 HD13 HG23 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.450000000000003 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 74.349999999999994 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.039999999999999 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.340000000000003 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.340000000000003 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.129999999999995 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 75.450000000000003 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 72.319999999999993 110.638 -178.59 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 109.444 -0.576 . . . . 72.209999999999994 109.444 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.129999999999995 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.511 HG23 HD13 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.140000000000001 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.219999999999999 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.439999999999998 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.040000000000006 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.310000000000002 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.439999999999998 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.230000000000004 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 74.409999999999997 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.200000000000003 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 75.230000000000004 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.140000000000001 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.299999999999997 113.752 172.879 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.604 -0.517 . . . . 72.409999999999997 109.604 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 71.420000000000002 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.450000000000003 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 75.140000000000001 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 75.099999999999994 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.53 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 24.9 t-20 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.150000000000006 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.239999999999995 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.349999999999994 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 64.519999999999996 108.836 -175.774 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.53 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.884 0.373 . . . . 72.329999999999998 110.141 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.349999999999994 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.109999999999999 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 74.349999999999994 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.230000000000004 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.430000000000007 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.436 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 74.25 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.239999999999995 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.420000000000002 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.409999999999997 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 71.319999999999993 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 75.400000000000006 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.310000000000002 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.549999999999997 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' HG22 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.430000000000007 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 72.349999999999994 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.439999999999998 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 73.319999999999993 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.402 ' O ' HD22 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 74.319999999999993 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.530000000000001 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.340000000000003 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 74.230000000000004 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.230000000000004 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 74.140000000000001 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.439999999999998 108.403 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.329999999999998 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 63.310000000000002 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 73.299999999999997 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 71.340000000000003 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.456 ' HB3' HD22 ' A' ' 16' ' ' ASN . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 64.120000000000005 108.186 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.019999999999996 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.420000000000002 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 65.519999999999996 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.019999999999996 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 74.230000000000004 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 70.310000000000002 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.415 ' HE ' ' HB2' ' A' ' 63' ' ' ARG . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.530000000000001 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 64.310000000000002 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HZ3' ' HG2' ' A' ' 69' ' ' GLU . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 73.209999999999994 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.140000000000001 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 74.430000000000007 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 75.319999999999993 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.435 ' HG2' ' HZ3' ' A' ' 65' ' ' LYS . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 75.120000000000005 112.029 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.099999999999994 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 72.140000000000001 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.140000000000001 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.120000000000005 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.129999999999995 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.5 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.567 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.510000000000005 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.319999999999993 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.452 HG22 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.319999999999993 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.120000000000005 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 74.420000000000002 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 72.5 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.402 HD22 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.530000000000001 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.040000000000006 111.368 -177.627 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.835 -0.431 . . . . 71.319999999999993 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 74.120000000000005 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.567 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.530000000000001 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.129999999999995 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 72.0 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 72.099999999999994 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 73.209999999999994 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.030000000000001 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.099999999999994 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 73.5 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 74.299999999999997 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.319999999999993 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 70.109999999999999 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.430000000000007 115.871 -179.338 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.219999999999999 110.642 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.510000000000005 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.019999999999996 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.420000000000002 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.109999999999999 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 71.319999999999993 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.299999999999997 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.606 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 35.7 m-80 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 73.099999999999994 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 61.119999999999997 109.317 -176.695 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 73.200000000000003 110.491 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.150000000000006 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.120000000000005 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 73.340000000000003 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 72.450000000000003 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.530000000000001 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.427 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.230000000000004 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.340000000000003 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.4 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 71.349999999999994 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.427 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 71.519999999999996 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.209999999999994 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.040000000000006 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 75.140000000000001 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 75.099999999999994 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.310000000000002 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 64.040000000000006 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 75.439999999999998 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 63.450000000000003 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 75.230000000000004 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.409999999999997 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 75.519999999999996 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 74.239999999999995 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.230000000000004 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.509999999999998 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.420000000000002 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.119999999999997 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.555 ' HZ1' ' HB3' ' A' ' 54' ' ' LYS . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.439999999999998 108.32 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 74.299999999999997 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 61.420000000000002 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.5 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 71.040000000000006 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.433 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 75.519999999999996 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.319999999999993 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.219999999999999 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' HG21 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 73.340000000000003 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 73.439999999999998 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.109999999999999 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 73.230000000000004 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.420000000000002 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.409999999999997 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.488 ' HA ' HG23 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.240000000000002 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 74.310000000000002 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.450000000000003 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.310000000000002 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.556 ' HB3' HG13 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.530000000000001 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 74.450000000000003 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 74.230000000000004 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.030000000000001 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 71.530000000000001 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.120000000000005 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 61.109999999999999 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.438 ' HB3' HD13 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.409999999999997 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.019999999999996 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.019999999999996 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.540000000000006 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 60.539999999999999 110.638 -179.202 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm . . . . . 0 CA--C 1.548 0.9 0 N-CA-C 110.816 -0.068 . . . . 73.239999999999995 110.816 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.019999999999996 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 72.040000000000006 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 72.209999999999994 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.299999999999997 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.420000000000002 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 73.340000000000003 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.230000000000004 109.989 174.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.433 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 70.439999999999998 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.556 HG13 ' HB3' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.049999999999997 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.340000000000003 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 74.319999999999993 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.400000000000006 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 75.310000000000002 112.269 175.855 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 110.393 -0.225 . . . . 71.209999999999994 110.393 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.483 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.040000000000006 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.439999999999998 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 71.109999999999999 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.200000000000003 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.009999999999998 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.329999999999998 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.409 ' ND2' ' HH ' ' A' ' 27' ' ' TYR . 13.9 m120 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.530000000000001 110.308 -173.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m . . . . . 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 75.319999999999993 108.042 172.601 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.409 ' HH ' ' ND2' ' A' ' 18' ' ' ASN . 23.1 p90 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.209999999999994 110.223 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.420000000000002 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.540000000000006 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.430000000000007 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 75.219999999999999 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 74.530000000000001 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.349999999999994 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 73.439999999999998 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 70.109999999999999 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 74.299999999999997 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.100000000000001 110.771 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 75.299999999999997 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.430000000000007 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.219999999999999 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.41 ' HB3' HG22 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 72.219999999999999 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 75.310000000000002 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.219999999999999 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.319999999999993 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.099999999999994 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.230000000000004 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 75.129999999999995 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.319999999999993 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 73.420000000000002 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 75.409999999999997 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.099999999999994 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 71.109999999999999 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 74.120000000000005 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.140000000000001 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.120000000000005 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 74.030000000000001 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 74.019999999999996 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.633 ' HB ' HD23 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 74.140000000000001 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 71.430000000000007 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.450000000000003 109.739 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.483 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.219999999999999 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 75.030000000000001 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.239999999999995 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 70.540000000000006 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 75.439999999999998 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 74.349999999999994 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 74.420000000000002 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.510000000000005 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 72.439999999999998 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.099999999999994 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 75.319999999999993 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HG22 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.319999999999993 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 55.210000000000001 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 74.019999999999996 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.633 HD23 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 74.420000000000002 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 65.239999999999995 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.41 HG22 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.400000000000006 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 74.530000000000001 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 62.109999999999999 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.019999999999996 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.450000000000003 113.28 -175.154 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.403 ' HB ' HG13 ' A' ' 76' ' ' ILE . 48.2 mm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.595 -0.52 . . . . 71.129999999999995 109.595 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.120000000000005 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.534 HG22 HD13 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 74.129999999999995 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 65.109999999999999 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 75.120000000000005 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.340000000000003 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.432 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 65.349999999999994 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.532 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.140000000000001 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.540000000000006 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.505 HG22 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.120000000000005 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.129999999999995 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.417 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.319999999999993 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.519999999999996 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.430000000000007 112.736 178.073 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 121.532 0.682 . . . . 74.299999999999997 112.025 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.495 HG23 HD21 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 73.340000000000003 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 74.540000000000006 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 73.420000000000002 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 74.25 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.319999999999993 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 74.230000000000004 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.412 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.319999999999993 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 74.540000000000006 109.546 -177.902 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.48 ' HH ' ' HB3' ' A' ' 47' ' ' TYR . 81.4 m-85 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 74.439999999999998 109.02 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 73.109999999999999 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.239999999999995 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 62.119999999999997 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.427 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.120000000000005 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.239999999999995 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.340000000000003 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 74.030000000000001 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.120000000000005 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' HG21 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.400000000000006 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.495 HD21 HG23 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.430000000000007 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.435 ' HG2' HD12 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 72.120000000000005 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.129999999999995 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.413 HG21 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.319999999999993 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.545 HD22 HD12 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 73.010000000000005 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.230000000000004 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.150000000000006 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.040000000000006 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.519999999999996 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 72.040000000000006 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB3' ' HH ' ' A' ' 27' ' ' TYR . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 73.239999999999995 111.524 -177.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.449 HG21 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.310000000000002 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 74.340000000000003 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.230000000000004 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.120000000000005 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.119999999999997 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.449 ' HB2' HG21 ' A' ' 48' ' ' ILE . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.530000000000001 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 73.219999999999999 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 73.140000000000001 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.400000000000006 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 74.420000000000002 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 71.120000000000005 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.545 HD12 HD22 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 75.140000000000001 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 73.209999999999994 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 74.540000000000006 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 72.340000000000003 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 72.439999999999998 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.319999999999993 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 74.030000000000001 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.129999999999995 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.219999999999999 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 74.319999999999993 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.319999999999993 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.429 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.200000000000003 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.099999999999994 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.435 HD12 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.549999999999997 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 71.120000000000005 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 74.329999999999998 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.340000000000003 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 75.129999999999995 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.349999999999994 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 75.439999999999998 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 73.219999999999999 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 72.040000000000006 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.130000000000003 112.049 -179.08 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.6 mm . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 109.198 -0.668 . . . . 73.239999999999995 109.198 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 73.010000000000005 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 71.109999999999999 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 72.450000000000003 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 74.120000000000005 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.430000000000007 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 55.420000000000002 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.530000000000001 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.430000000000007 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 72.319999999999993 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 73.239999999999995 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.130000000000003 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.420000000000002 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 75.109999999999999 113.093 176.143 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.223 0.535 . . . . 73.329999999999998 110.525 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.537 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.420000000000002 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 70.430000000000007 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 73.230000000000004 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.310000000000002 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.631 HD22 HD13 ' A' ' 44' ' ' LEU . 15.8 m120 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 70.430000000000007 109.548 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.559 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 75.040000000000006 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.540000000000006 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.239999999999995 110.729 -174.795 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.607 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 121.019 0.438 . . . . 74.319999999999993 110.758 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 74.209999999999994 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.409999999999997 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.310000000000002 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 75.340000000000003 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.200000000000003 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.728 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 63.5 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 74.349999999999994 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.109999999999999 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.728 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.430000000000007 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 HG22 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.129999999999995 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 73.530000000000001 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 74.219999999999999 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.010000000000005 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 75.200000000000003 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.120000000000005 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.519999999999996 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 16' ' ' ASN . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.099999999999994 110.635 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 72.25 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.519999999999996 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 73.519999999999996 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.556 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.239999999999995 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.439999999999998 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 70.510000000000005 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.607 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 71.150000000000006 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 72.510000000000005 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.150000000000006 108.747 172.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.209999999999994 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.121 -172.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.319999999999993 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.596 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.409999999999997 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 73.109999999999999 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.349999999999994 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 74.340000000000003 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 74.209999999999994 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.340000000000003 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.109999999999999 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 73.439999999999998 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 74.530000000000001 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 63.340000000000003 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 75.409999999999997 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 73.150000000000006 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.129999999999995 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 73.349999999999994 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.400000000000006 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 64.430000000000007 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 74.510000000000005 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.409999999999997 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HG23 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 73.120000000000005 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.495 ' HD2' HG21 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 73.099999999999994 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.464 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.209999999999994 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.510000000000005 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.150000000000006 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.030000000000001 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 74.010000000000005 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.340000000000003 111.11 -177.636 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.507 HG22 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.023 -0.732 . . . . 75.450000000000003 109.023 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.530000000000001 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.564 HG23 HD12 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 74.219999999999999 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 72.040000000000006 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.230000000000004 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.319999999999993 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.409999999999997 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 63.409999999999997 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 75.040000000000006 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 62.350000000000001 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.420000000000002 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 75.430000000000007 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.596 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 64.140000000000001 110.66 -178.517 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 121.106 0.479 . . . . 65.140000000000001 111.133 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.432 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.210000000000001 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 73.430000000000007 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.414 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.519999999999996 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 65.299999999999997 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.424 HD22 HD23 ' A' ' 44' ' ' LEU . 13.9 m120 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.299999999999997 109.827 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.209999999999994 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.340000000000003 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.505 ' HG1' ' HB2' ' A' ' 54' ' ' LYS . 24.8 p . . . . . 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.129999999999995 108.419 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.814 0.34 . . . . 73.340000000000003 111.703 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.450000000000003 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.414 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.430000000000007 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 70.109999999999999 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.540000000000006 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 74.219999999999999 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.519999999999996 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 72.120000000000005 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.329999999999998 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.049999999999997 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 71.129999999999995 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.540000000000006 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 72.030000000000001 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.120000000000005 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.109999999999999 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.519999999999996 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.424 HD23 HD22 ' A' ' 16' ' ' ASN . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 73.349999999999994 110.649 -173.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 72.030000000000001 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 74.019999999999996 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.229999999999997 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.420000000000002 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 74.040000000000006 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.049999999999997 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 73.030000000000001 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 74.010000000000005 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.519999999999996 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.505 ' HB2' ' HG1' ' A' ' 19' ' ' THR . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.209999999999994 108.027 172.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.510000000000005 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 75.349999999999994 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.450000000000003 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 72.140000000000001 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 75.109999999999999 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.432 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 71.239999999999995 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 73.319999999999993 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 75.219999999999999 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.510000000000005 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.519999999999996 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 74.299999999999997 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.439999999999998 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.230000000000004 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 75.140000000000001 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 74.319999999999993 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.340000000000003 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.340000000000003 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.439999999999998 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 72.049999999999997 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 74.129999999999995 111.367 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.099999999999994 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 74.109999999999999 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 73.209999999999994 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.239999999999995 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 73.239999999999995 110.502 176.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.430000000000007 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 75.329999999999998 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.340000000000003 112.722 -175.672 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.433 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.392 -0.596 . . . . 64.239999999999995 109.392 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 65.099999999999994 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.534 ' HB ' HD13 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 73.140000000000001 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 73.040000000000006 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.430000000000007 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 71.239999999999995 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.209999999999994 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.539 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.010000000000005 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 65.549999999999997 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 75.120000000000005 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 64.140000000000001 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.329999999999998 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.439999999999998 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 61.340000000000003 113.181 176.088 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.420000000000002 108.232 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.584 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 74.310000000000002 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.129999999999995 108.841 177.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.210000000000001 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 74.200000000000003 108.46 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 70.400000000000006 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 73.319999999999993 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.510000000000005 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.427 ' HG1' ' HB3' ' A' ' 55' ' ' ARG . 40.2 p . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.450000000000003 110.085 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 121.012 0.434 . . . . 64.209999999999994 111.081 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 73.540000000000006 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 72.209999999999994 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.019999999999996 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.492 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.450000000000003 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 72.310000000000002 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.662 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.430000000000007 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.219999999999999 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.209999999999994 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.662 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.340000000000003 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 65.319999999999993 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.129999999999995 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 74.140000000000001 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.109999999999999 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.340000000000003 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.420000000000002 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.150000000000006 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.299999999999997 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 71.430000000000007 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.109999999999999 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.546 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.329999999999998 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.439 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 75.129999999999995 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 74.409999999999997 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 73.230000000000004 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 71.099999999999994 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.019999999999996 114.502 172.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 73.540000000000006 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 75.530000000000001 111.684 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HB3' ' HG1' ' A' ' 19' ' ' THR . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 74.430000000000007 108.147 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 72.420000000000002 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.239999999999995 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.514 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.010000000000005 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 75.219999999999999 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 74.019999999999996 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.584 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.310000000000002 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 63.130000000000003 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.299999999999997 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 74.319999999999993 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 74.549999999999997 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.409999999999997 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.150000000000006 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.329999999999998 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.329999999999998 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.517 ' HB1' HG23 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.230000000000004 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.519999999999996 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.420000000000002 110.467 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.514 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.409999999999997 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.477 HD12 HG23 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 75.209999999999994 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 74.420000000000002 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 71.099999999999994 110.628 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.450000000000003 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.109999999999999 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.239999999999995 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.439 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 65.120000000000005 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 73.140000000000001 110.796 178.171 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.0 mm . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.599 0.238 . . . . 73.310000000000002 111.551 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 74.150000000000006 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.477 HG23 HD12 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.219999999999999 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 65.129999999999995 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.310000000000002 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.129999999999995 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 70.209999999999994 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.517 HG23 ' HB1' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.310000000000002 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.030000000000001 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.040000000000006 108.06 171.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.310000000000002 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.019999999999996 113.47 175.954 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 121.134 0.492 . . . . 74.140000000000001 109.789 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.319999999999993 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.230000000000004 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 75.150000000000006 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.109999999999999 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.639 HD22 HD22 ' A' ' 44' ' ' LEU . 16.4 m120 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 71.120000000000005 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 73.230000000000004 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 74.219999999999999 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 65.129999999999995 107.483 175.091 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.010000000000005 108.333 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 71.430000000000007 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.319999999999993 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.530000000000001 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 71.239999999999995 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 73.439999999999998 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.416 HG21 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.209999999999994 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.416 ' H ' HG21 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 72.230000000000004 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.239999999999995 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.439 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 74.310000000000002 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.349999999999994 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 74.439999999999998 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.400000000000006 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 75.120000000000005 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 74.129999999999995 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.040000000000006 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.639 HD22 HD22 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.400000000000006 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.540000000000006 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.340000000000003 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.219999999999999 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.41 HD11 ' ND2' ' A' ' 16' ' ' ASN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.420000000000002 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 74.319999999999993 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 72.040000000000006 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.030000000000001 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.519999999999996 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.450000000000003 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 74.319999999999993 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.200000000000003 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 65.329999999999998 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 74.530000000000001 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 71.319999999999993 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.299999999999997 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 71.25 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.540000000000006 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 71.340000000000003 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.329999999999998 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.430000000000007 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 74.150000000000006 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 74.099999999999994 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 72.230000000000004 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.409999999999997 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.409999999999997 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 74.439999999999998 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 64.329999999999998 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 72.109999999999999 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 75.450000000000003 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.437 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.450000000000003 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.553 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 71.409999999999997 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.200000000000003 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.239999999999995 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 74.239999999999995 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.299999999999997 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 71.099999999999994 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 74.129999999999995 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.450000000000003 111.165 176.65 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 74.319999999999993 108.024 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 75.5 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.553 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 64.239999999999995 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.340000000000003 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.310000000000002 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 73.030000000000001 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 61.32 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.626 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 73.540000000000006 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 75.340000000000003 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 72.099999999999994 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 74.439999999999998 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.437 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.310000000000002 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.420000000000002 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.299999999999997 112.499 167.421 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 C--O 1.242 0.687 0 CA-C-O 120.887 0.375 . . . . 70.099999999999994 110.799 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 72.230000000000004 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.099999999999994 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 75.140000000000001 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.230000000000004 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.049999999999997 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.400000000000006 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.439999999999998 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 74.530000000000001 108.384 171.954 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.409999999999997 108.423 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.240000000000002 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.150000000000006 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.129999999999995 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.329999999999998 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 73.5 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 73.329999999999998 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.420000000000002 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.340000000000003 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.230000000000004 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.437 HD23 HG23 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 70.030000000000001 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.310000000000002 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.510000000000005 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 71.129999999999995 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.010000000000005 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.239999999999995 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.430000000000007 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.520000000000003 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.219999999999999 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.099999999999994 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 71.540000000000006 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.445 HG21 HD11 ' A' ' 82' ' ' LEU . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 74.299999999999997 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 74.140000000000001 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 75.219999999999999 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.607 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 26.3 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.340000000000003 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 74.450000000000003 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.607 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.219999999999999 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 70.439999999999998 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.329999999999998 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 72.439999999999998 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 74.239999999999995 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.310000000000002 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.509 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.310000000000002 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 73.030000000000001 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.602 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 73.439999999999998 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.109999999999999 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 74.420000000000002 110.245 -169.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.450000000000003 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.430000000000007 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 73.049999999999997 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 64.019999999999996 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.200000000000003 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.049999999999997 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.540000000000006 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 75.219999999999999 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.349999999999994 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 75.150000000000006 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.530000000000001 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.608 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.420000000000002 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HD2' HG23 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.099999999999994 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 73.129999999999995 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 72.349999999999994 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 74.430000000000007 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 75.439999999999998 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.230000000000004 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.608 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.44 -0.578 . . . . 72.310000000000002 109.44 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 74.340000000000003 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.508 ' HB ' HG23 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 72.329999999999998 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 74.510000000000005 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 73.340000000000003 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.549999999999997 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.400000000000006 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.319999999999993 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.299999999999997 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 55.039999999999999 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.508 HG23 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 65.120000000000005 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.340000000000003 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.430000000000007 113.508 171.454 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 C--O 1.242 0.702 0 N-CA-C 109.905 -0.406 . . . . 74.140000000000001 109.905 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.435 HG21 HD12 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.219999999999999 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.430000000000007 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.434 HG21 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.400000000000006 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.299999999999997 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.319999999999993 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.310000000000002 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 72.230000000000004 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 74.120000000000005 109.986 177.058 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.36 0.6 . . . . 73.140000000000001 109.45 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.439999999999998 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.409999999999997 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.209999999999994 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 72.0 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.209999999999994 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.430000000000007 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 73.230000000000004 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.435 ' H ' HG23 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 70.209999999999994 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.400000000000006 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.435 HD12 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.240000000000002 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 73.450000000000003 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.120000000000005 110.879 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.450000000000003 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 113.309 -170.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 74.010000000000005 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 72.400000000000006 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.349999999999994 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 73.310000000000002 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.109999999999999 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 73.25 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.472 HD12 ' HG ' ' A' ' 56' ' ' SER . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 75.530000000000001 109.359 175.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.120000000000005 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.400000000000006 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 75.219999999999999 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 74.099999999999994 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 64.319999999999993 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 74.329999999999998 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.010000000000005 107.851 172.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.472 ' HG ' HD12 ' A' ' 48' ' ' ILE . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 73.120000000000005 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.219999999999999 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 75.450000000000003 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.434 HG12 HG21 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 63.450000000000003 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 74.319999999999993 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 72.239999999999995 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.400000000000006 113.368 -169.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.549999999999997 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 74.319999999999993 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.030000000000001 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 64.129999999999995 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 74.5 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.299999999999997 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 72.420000000000002 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 74.239999999999995 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 71.310000000000002 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 71.329999999999998 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 64.409999999999997 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.431 HD23 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.239999999999995 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.472 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.230000000000004 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.409999999999997 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.466 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 75.0 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . 0.475 ' HB3' HD13 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.219999999999999 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 74.25 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.549999999999997 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 73.530000000000001 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.420000000000002 113.44 -179.218 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.530000000000001 107.71 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 72.140000000000001 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.472 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 74.109999999999999 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.219999999999999 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 75.040000000000006 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.439999999999998 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.010000000000005 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.230000000000004 110.113 176.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.439999999999998 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 73.439999999999998 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.549999999999997 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 74.329999999999998 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.430000000000007 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.020000000000003 113.166 170.819 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.154 0.502 . . . . 73.219999999999999 111.925 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.56 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 75.439999999999998 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.100000000000001 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.409999999999997 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.530000000000001 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.46 ' HB2' HD23 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.100000000000001 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 64.420000000000002 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' SG ' ' A' ' 53' ' ' CYS . 85.2 m-20 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.230000000000004 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.530000000000001 108.534 -179.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 112.055 0.391 . . . . 75.129999999999995 112.055 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 73.120000000000005 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.239999999999995 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 65.400000000000006 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 64.409999999999997 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.541 HG21 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.019999999999996 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.4 ' HA ' ' HB3' ' A' ' 37' ' ' LEU . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 61.0 111.795 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.541 ' H ' HG21 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 64.049999999999997 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 72.230000000000004 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 72.219999999999999 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.340000000000003 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HZ1' ' HB2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 72.25 111.324 -178.068 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.230000000000004 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.030000000000001 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 73.200000000000003 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 72.439999999999998 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.120000000000005 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.109999999999999 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.140000000000001 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.409999999999997 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 65.219999999999999 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 75.409999999999997 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 72.040000000000006 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.413 ' SG ' ' ND2' ' A' ' 18' ' ' ASN . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.219999999999999 109.964 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 73.230000000000004 110.551 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 74.420000000000002 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 61.420000000000002 111.2 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 74.340000000000003 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.41 ' HB ' HD12 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 75.239999999999995 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.229999999999997 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 74.219999999999999 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.56 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 74.099999999999994 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB2' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.119999999999997 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.639 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 72.340000000000003 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 74.230000000000004 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.239999999999995 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.329999999999998 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.310000000000002 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.030000000000001 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.229999999999997 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 75.219999999999999 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.340000000000003 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.442 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.409999999999997 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.049999999999997 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 71.420000000000002 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.41 HD12 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.340000000000003 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.504 HD12 HG21 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 74.150000000000006 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.129999999999995 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.403 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 72.109999999999999 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.329999999999998 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 72.040000000000006 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.129999999999995 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 64.540000000000006 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.019999999999996 111.898 -176.565 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 120.571 0.224 . . . . 75.129999999999995 110.951 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 74.510000000000005 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.504 HG21 HD12 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 74.400000000000006 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.140000000000001 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . 0.458 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.519999999999996 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.019999999999996 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 74.340000000000003 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.639 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.120000000000005 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.109999999999999 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 63.100000000000001 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 61.210000000000001 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 75.109999999999999 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.409999999999997 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.140000000000001 111.943 179.143 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 121.114 0.483 . . . . 73.349999999999994 111.476 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.209999999999994 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.420000000000002 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 63.039999999999999 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 74.25 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.340000000000003 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 75.129999999999995 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.482 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.430000000000007 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m . . . . . 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.040000000000006 110.743 -174.436 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.556 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 108.693 -0.855 . . . . 75.340000000000003 108.693 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.219999999999999 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 72.120000000000005 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.099999999999994 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.040000000000006 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.530000000000001 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 72.200000000000003 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 38' ' ' GLN . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.310000000000002 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 75.129999999999995 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.53 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.329999999999998 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 75.209999999999994 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.510000000000005 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.140000000000001 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HB3' HG22 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 75.430000000000007 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.340000000000003 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.439999999999998 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.556 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.439999999999998 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HB2' HG11 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 74.150000000000006 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.530000000000001 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 64.239999999999995 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 75.209999999999994 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 74.530000000000001 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.439999999999998 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.400000000000006 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.030000000000001 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.510000000000005 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.430000000000007 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 72.209999999999994 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.423 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.519999999999996 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.589 ' HB ' HD22 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 71.129999999999995 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.340000000000003 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 75.150000000000006 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.439999999999998 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 74.340000000000003 110.226 -175.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.575 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.540000000000006 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.230000000000004 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 71.409999999999997 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.310000000000002 111.83 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.329999999999998 110.511 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.430000000000007 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 73.349999999999994 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.209999999999994 111.252 -175.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.438 ' O ' HD11 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 73.439999999999998 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.430000000000007 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 74.450000000000003 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.349999999999994 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.438 HD11 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.519999999999996 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 75.120000000000005 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 65.349999999999994 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.510000000000005 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 73.420000000000002 111.017 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 71.230000000000004 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.299999999999997 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.230000000000004 112.079 -172.925 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 74.530000000000001 107.281 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 74.420000000000002 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.426 ' HA ' HG21 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.340000000000003 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.310000000000002 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.230000000000004 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.040000000000006 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.575 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.209999999999994 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 71.310000000000002 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.482 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 62.210000000000001 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.482 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 72.450000000000003 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.482 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.319999999999993 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . 0.423 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.5 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 54.409999999999997 114.029 168.027 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.441 -0.577 . . . . 72.25 109.441 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.140000000000001 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.439999999999998 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 74.319999999999993 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 28' ' ' THR . 98.9 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 74.109999999999999 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 25.1 t-20 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.450000000000003 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.430000000000007 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 71.140000000000001 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p . . . . . 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.030000000000001 110.883 -173.579 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.495 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 . . . . . 0 CA--C 1.542 0.659 0 CA-C-O 121.21 0.528 . . . . 73.349999999999994 110.128 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.513 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 71.349999999999994 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.539999999999999 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.230000000000004 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 75.319999999999993 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 60.32 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . 0.483 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 73.0 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.329999999999998 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.491 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.430000000000007 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 73.450000000000003 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.412 HD12 HD12 ' A' ' 60' ' ' ILE . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 74.530000000000001 111.523 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.530000000000001 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 75.120000000000005 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.209999999999994 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.310000000000002 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 72.329999999999998 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 74.430000000000007 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.120000000000005 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.510000000000005 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 71.310000000000002 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.476 HD12 ' HG ' ' A' ' 56' ' ' SER . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 72.510000000000005 109.979 176.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 71.140000000000001 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 74.310000000000002 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.439999999999998 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.430000000000007 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 72.430000000000007 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 73.230000000000004 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 73.340000000000003 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.219999999999999 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.140000000000001 108.634 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.412 HD12 HD12 ' A' ' 37' ' ' LEU . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 75.450000000000003 109.474 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 74.040000000000006 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.531 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.299999999999997 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 75.340000000000003 112.531 -168.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 74.409999999999997 110.408 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.200000000000003 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 73.099999999999994 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 74.439999999999998 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 72.219999999999999 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.439999999999998 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.41 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.329999999999998 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.439999999999998 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.475 ' HB1' HG22 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 73.409999999999997 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.405 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 75.430000000000007 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 72.349999999999994 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.484 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 72.549999999999997 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.405 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.239999999999995 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.506 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.319999999999993 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.239999999999995 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 63.509999999999998 110.587 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.200000000000003 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 75.420000000000002 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.349999999999994 111.245 -177.557 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.628 -0.508 . . . . 73.049999999999997 109.628 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.129999999999995 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.484 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 74.230000000000004 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 75.120000000000005 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.420000000000002 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.420000000000002 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 64.239999999999995 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.319999999999993 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 75.420000000000002 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . 0.475 HG22 ' HB1' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.009999999999998 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.310000000000002 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 72.120000000000005 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 65.150000000000006 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 74.329999999999998 114.361 170.992 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.140000000000001 110.519 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 75.299999999999997 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.510000000000005 108.967 172.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 73.310000000000002 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.209999999999994 109.161 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 73.049999999999997 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.439999999999998 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.462 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.430000000000007 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 74.239999999999995 107.422 168.977 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 109.778 -0.453 . . . . 74.349999999999994 109.778 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 75.540000000000006 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.450000000000003 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 73.439999999999998 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 75.349999999999994 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.340000000000003 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 75.439999999999998 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 74.439999999999998 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.420000000000002 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.510000000000005 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.459 HD13 HD12 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 74.109999999999999 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 74.019999999999996 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.519999999999996 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 73.319999999999993 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 75.329999999999998 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 70.329999999999998 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.420000000000002 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 74.519999999999996 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.329999999999998 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 75.540000000000006 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.319999999999993 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.635 HG22 ' HG ' ' A' ' 53' ' ' CYS . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 73.340000000000003 110.878 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.430000000000007 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 73.409999999999997 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.149999999999999 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 71.109999999999999 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.635 ' HG ' HG22 ' A' ' 48' ' ' ILE . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.019999999999996 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.340000000000003 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.47 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 75.420000000000002 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 54.439999999999998 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.420000000000002 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 75.230000000000004 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.150000000000006 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.459 HD12 HD13 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.040000000000006 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.209999999999994 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.439999999999998 108.582 171.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 74.099999999999994 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.450000000000003 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 74.230000000000004 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.430000000000007 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 74.439999999999998 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 74.230000000000004 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.150000000000006 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.239999999999995 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' HG23 ' A' ' 89' ' ' VAL . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.510000000000005 111.051 176.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 54.020000000000003 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.433 ' O ' HG22 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.450000000000003 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.421 ' HB2' HG22 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 72.030000000000001 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 74.239999999999995 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 75.510000000000005 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.409999999999997 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 75.010000000000005 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.130000000000003 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.439999999999998 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 72.109999999999999 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.420000000000002 112.344 -175.675 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.211 -0.292 . . . . 75.140000000000001 110.211 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.349999999999994 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.435 HG23 ' HB3' ' A' ' 72' ' ' ALA . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 74.049999999999997 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 72.120000000000005 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 65.349999999999994 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.019999999999996 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.230000000000004 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.230000000000004 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' THR . . . . . 0.415 HG23 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.349999999999994 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 75.239999999999995 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.409999999999997 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.421 HG22 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.540000000000006 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.450000000000003 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.129999999999995 112.878 173.495 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.702 -0.481 . . . . 70.129999999999995 109.702 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -121.58 -69.29 0.84 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 108.054 -1.091 . . . . 74.219999999999999 108.054 170.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 56.68 66.58 1.15 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.906 1.282 . . . . 70.519999999999996 111.213 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -65.0 143.46 57.94 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.88 -0.415 . . . . 75.439999999999998 109.88 176.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -67.44 89.17 0.22 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.554 0.692 . . . . 71.329999999999998 110.322 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -99.47 160.11 14.53 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.188 0.995 . . . . 73.420000000000002 110.181 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -93.52 -3.62 52.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.674 -0.694 . . . . 62.5 111.025 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.81 95.78 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.13 0.572 . . . . 73.329999999999998 109.871 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -68.55 130.28 42.4 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.873 0.869 . . . . 64.430000000000007 110.908 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.56 -25.26 0.18 Allowed Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.518 -0.633 . . . . 71.439999999999998 111.518 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -79.68 162.72 25.05 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.773 0.829 . . . . 75.409999999999997 110.766 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.47 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 71.019999999999996 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 73.219999999999999 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.019999999999996 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 73.120000000000005 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.406 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.450000000000003 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 75.400000000000006 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.430000000000007 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p -107.55 111.43 23.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 75.129999999999995 109.235 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.428 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 46.1 m -146.12 -49.85 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.595 1.158 . . . . 64.349999999999994 108.426 -175.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.567 ' HB3' ' HE2' ' A' ' 25' ' ' PHE . 22.8 t-20 -144.3 -39.55 0.28 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 113.986 -1.461 . . . . 74.319999999999993 107.949 173.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 179.03 -171.72 43.81 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 115.048 -0.978 . . . . 75.319999999999993 111.612 172.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -78.96 4.16 15.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.945 0.898 . . . . 74.420000000000002 110.811 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.8 t -61.03 -19.29 61.19 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.685 0.794 . . . . 54.009999999999998 111.216 170.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.567 ' HE2' ' HB3' ' A' ' 21' ' ' ASN . 90.5 m-85 -96.86 22.48 8.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.371 1.068 . . . . 70.129999999999995 111.565 175.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -63.45 146.73 53.01 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 119.362 0.983 . . . . 73.019999999999996 110.83 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 -123.84 83.01 2.08 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 65.209999999999994 108.561 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.400000000000006 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.209999999999994 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.219999999999999 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.140000000000001 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 64.420000000000002 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.442 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 75.219999999999999 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 75.099999999999994 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.299999999999997 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.442 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.430000000000007 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.409999999999997 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.310000000000002 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.319999999999993 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.129999999999995 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.425 ' HB3' HG22 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.450000000000003 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.120000000000005 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.129999999999995 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.409999999999997 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.57 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 72.310000000000002 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 72.120000000000005 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.239999999999995 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.140000000000001 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 75.219999999999999 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 75.019999999999996 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.349999999999994 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 62.520000000000003 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.428 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.25 109.83 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.319999999999993 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.299999999999997 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.310000000000002 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.429 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 74.540000000000006 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.426 ' HB ' HD22 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.420000000000002 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.219999999999999 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.477 HG23 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.450000000000003 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.200000000000003 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.451 ' HB2' HG22 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.430000000000007 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.414 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.209999999999994 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.340000000000003 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.540000000000006 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.319999999999993 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.426 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 73.140000000000001 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.400000000000006 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.340000000000003 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.434 ' HB2' ' HZ2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.329999999999998 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.477 ' HB3' HG23 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.340000000000003 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 62.030000000000001 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.310000000000002 110.465 177.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.426 HD22 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 74.319999999999993 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 74.239999999999995 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.409999999999997 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.57 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 72.510000000000005 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.310000000000002 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 74.439999999999998 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 64.129999999999995 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.76 106.38 0.29 Allowed Glycine 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.209999999999994 109.256 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -74.75 70.9 1.92 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.113 0.965 . . . . 64.200000000000003 110.237 -174.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -132.79 178.79 6.59 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.209 -1.36 . . . . 74.129999999999995 108.609 -173.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.06 136.23 52.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.321 -0.992 . . . . 74.430000000000007 108.321 163.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm -114.96 143.92 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 75.329999999999998 108.984 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.745 ' HB2' ' HA ' ' A' ' 101' ' ' GLN . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 72.519999999999996 110.554 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.239999999999995 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 75.439999999999998 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.400000000000006 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.414 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.009999999999998 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 74.349999999999994 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.451 HG22 ' HB2' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 53.030000000000001 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 73.409999999999997 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.129999999999995 109.846 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.429 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.129999999999995 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 66.73 -147.65 49.83 Favored Glycine 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 65.120000000000005 114.033 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.745 ' HA ' ' HB2' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -151.03 137.38 18.54 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.662 -0.866 . . . . 75.310000000000002 108.662 175.954 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.22 134.49 48.11 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.535 0.734 . . . . 71.400000000000006 110.13 178.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -136.89 156.87 47.91 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.785 0.834 . . . . 71.049999999999997 110.132 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.34 -95.2 0.17 Allowed Glycine 0 C--N 1.35 1.319 0 O-C-N 123.654 0.596 . . . . 71.409999999999997 112.83 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 39.9 t -69.36 107.03 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.539 0 N-CA-C 108.549 -0.908 . . . . 75.25 108.549 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 C--O 1.244 0.808 0 N-CA-C 108.96 -0.756 . . . . 74.329999999999998 108.96 -178.756 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.549 ' HB2' ' HB3' ' A' ' 92' ' ' ASP . 1.6 mpt? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.968 -0.382 . . . . 64.239999999999995 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -146.83 85.2 1.62 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.036 0.934 . . . . 71.439999999999998 108.962 173.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -141.68 109.12 5.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.038 0.535 . . . . 65.409999999999997 110.171 -175.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -128.22 135.38 49.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 108.321 -0.992 . . . . 74.329999999999998 108.321 176.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -148.76 113.69 5.44 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.632 0.773 . . . . 64.420000000000002 109.231 -174.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -117.85 79.18 1.32 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.806 0.813 . . . . 71.540000000000006 109.068 176.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -86.03 -27.78 24.56 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.123 -0.944 . . . . 74.299999999999997 108.964 166.621 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -130.25 169.85 14.87 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 125.55 1.54 . . . . 74.239999999999995 108.708 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.4 p -67.01 -47.26 72.0 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 108.452 -0.944 . . . . 74.010000000000005 108.452 168.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.65 151.68 4.1 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 114.924 -1.035 . . . . 74.200000000000003 113.58 172.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -74.75 154.17 38.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.415 0.686 . . . . 74.340000000000003 110.609 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.548 HG22 HD23 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 71.219999999999999 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.420000000000002 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.200000000000003 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.549999999999997 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 73.030000000000001 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 63.140000000000001 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 73.209999999999994 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m -108.33 110.58 22.19 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 70.5 108.257 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -162.65 82.0 0.51 Allowed 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.048 -1.093 . . . . 71.019999999999996 108.048 -172.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -60.32 103.74 0.26 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.9 0.88 . . . . 73.420000000000002 110.095 -175.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 146.88 -51.34 0.58 Allowed Glycine 0 C--O 1.241 0.537 0 CA-C-N 114.804 -1.089 . . . . 72.510000000000005 110.488 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -162.93 127.24 3.0 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.971 0.509 . . . . 73.219999999999999 110.624 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.4 p -132.92 101.6 5.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.604 1.161 . . . . 75.329999999999998 109.033 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -73.18 105.56 4.66 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.819 -0.808 . . . . 74.439999999999998 108.819 171.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -82.29 142.17 32.3 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.791 0.836 . . . . 75.519999999999996 110.422 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -142.77 82.86 1.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.510000000000005 110.292 -173.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.109999999999999 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.472 ' HH ' ' HE2' ' A' ' 47' ' ' TYR . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 74.120000000000005 109.573 179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.420000000000002 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.469 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.420000000000002 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.329999999999998 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.503 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.099999999999994 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.474 ' HG2' HE21 ' A' ' 38' ' ' GLN . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.030000000000001 111.634 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.420000000000002 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.503 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 63.229999999999997 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.548 HD23 HG22 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 74.5 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.474 HE21 ' HG2' ' A' ' 34' ' ' GLU . 71.9 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.209999999999994 111.713 -177.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.200000000000003 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 74.120000000000005 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.329999999999998 112.51 -178.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.420000000000002 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 74.349999999999994 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.549999999999997 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.450000000000003 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 63.530000000000001 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.472 ' HE2' ' HH ' ' A' ' 29' ' ' TYR . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.430000000000007 111.061 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 72.219999999999999 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.129999999999995 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 74.430000000000007 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 52.009999999999998 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.010000000000005 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.140000000000001 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.409999999999997 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.450000000000003 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.549999999999997 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 75.310000000000002 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 72.519999999999996 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 74.420000000000002 109.767 -175.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.140000000000001 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 71' ' ' PHE . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 63.549999999999997 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.42 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.450000000000003 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.402 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 71.319999999999993 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.030000000000001 115.113 -168.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.549999999999997 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.329999999999998 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.420000000000002 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.129999999999995 111.389 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 74.230000000000004 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.539 ' HD2' ' HB1' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.450000000000003 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.239999999999995 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.413 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.350000000000001 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.549999999999997 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 72.510000000000005 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 71.519999999999996 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.230000000000004 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 64.430000000000007 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.019999999999996 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.423 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.299999999999997 111.602 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 73.439999999999998 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 72.340000000000003 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.01 -79.63 0.05 OUTLIER Glycine 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.450000000000003 113.183 -174.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.423 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 26.3 t80 -160.88 155.17 23.13 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.046 -0.724 . . . . 72.430000000000007 109.046 -170.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.96 -39.03 72.81 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 118.624 0.647 . . . . 74.120000000000005 112.157 -175.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.53 88.29 4.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.372 0.669 . . . . 74.209999999999994 109.769 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm -112.84 148.25 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.007 0.923 . . . . 73.530000000000001 110.053 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.415 ' H ' ' HA ' ' A' ' 101' ' ' GLN . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.209999999999994 110.536 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 72.120000000000005 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.319999999999993 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 74.239999999999995 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.549 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 64.310000000000002 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 75.030000000000001 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.140000000000001 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.515 HG22 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 74.340000000000003 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.230000000000004 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 72.340000000000003 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 60.8 -113.23 5.36 Favored Glycine 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.430000000000007 113.428 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.415 ' HA ' ' H ' ' A' ' 88' ' ' ASN . 18.7 pt20 -161.41 170.87 19.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.431 1.092 . . . . 64.319999999999993 109.965 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.55 133.22 50.18 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 124.007 0.817 . . . . 75.510000000000005 111.933 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.64 -34.16 46.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.362 0.665 . . . . 75.430000000000007 110.223 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 146.59 -71.05 0.34 Allowed Glycine 0 C--N 1.347 1.169 0 N-CA-C 110.98 -0.848 . . . . 70.450000000000003 110.98 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.6 t 49.94 78.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 125.045 1.338 . . . . 75.209999999999994 111.146 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.051 0.941 . . . . 73.219999999999999 108.549 -177.973 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 109.927 -0.397 . . . . 75.200000000000003 109.927 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 62.39 45.28 6.65 Favored 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 124.546 1.138 . . . . 73.019999999999996 110.909 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -89.11 75.55 7.88 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 122.375 1.083 . . . . 74.519999999999996 109.741 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -65.49 124.53 22.54 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.534 -1.212 . . . . 65.420000000000002 110.703 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -129.57 155.08 46.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.072 0.949 . . . . 75.409999999999997 110.089 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.83 99.27 2.61 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.671 0.789 . . . . 75.5 109.793 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -110.9 -28.94 8.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.427 -0.953 . . . . 72.019999999999996 108.427 166.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -117.41 167.83 10.91 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.958 1.303 . . . . 64.310000000000002 109.193 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -86.85 49.49 1.83 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 121.733 0.778 . . . . 62.350000000000001 110.173 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.72 48.8 3.08 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-N 115.372 -0.831 . . . . 73.219999999999999 111.081 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -87.8 129.49 35.17 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.961 0.904 . . . . 75.519999999999996 109.924 -174.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.434 HG23 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 62.149999999999999 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 75.25 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 74.310000000000002 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.450000000000003 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.65 HD22 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.420000000000002 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.030000000000001 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.481 ' HB3' HD22 ' A' ' 21' ' ' ASN . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.439999999999998 108.999 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m -105.9 137.36 43.92 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.530000000000001 109.813 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 49.8 t 62.41 76.66 0.36 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.716 1.206 . . . . 71.120000000000005 111.065 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.481 HD22 ' HB3' ' A' ' 18' ' ' ASN . 9.6 m120 -113.92 -35.88 4.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.874 -1.057 . . . . 72.120000000000005 109.414 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.35 -69.2 2.57 Favored Glycine 0 C--N 1.354 1.549 0 N-CA-C 110.416 -1.074 . . . . 74.409999999999997 110.416 -171.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -83.83 80.96 8.97 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.513 1.125 . . . . 74.400000000000006 109.558 170.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.2 p -88.22 116.87 26.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.299 -0.864 . . . . 72.349999999999994 110.123 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -106.26 -169.83 1.63 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.69 0.796 . . . . 73.219999999999999 109.814 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.06 107.45 1.53 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.25 0.548 . . . . 73.299999999999997 110.115 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.525 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 -102.44 -4.98 24.61 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.11 -0.95 . . . . 72.430000000000007 109.708 170.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.239999999999995 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 75.409999999999997 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 71.430000000000007 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 73.519999999999996 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.140000000000001 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.597 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.200000000000003 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.219999999999999 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.100000000000001 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.597 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 70.310000000000002 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.434 HD22 HG23 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 72.430000000000007 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.439999999999998 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.25 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 74.400000000000006 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.120000000000005 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 63.329999999999998 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.439999999999998 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 74.140000000000001 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.435 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 74.519999999999996 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.436 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.109999999999999 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 72.140000000000001 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.537 HD11 ' HG ' ' A' ' 56' ' ' SER . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.019999999999996 110.252 -178.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 73.140000000000001 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 72.109999999999999 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 64.439999999999998 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' HD21 ' A' ' 21' ' ' ASN . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 64.310000000000002 111.011 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.439999999999998 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 74.430000000000007 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.439999999999998 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.65 ' HB2' HD22 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.140000000000001 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.471 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.420000000000002 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.540000000000006 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG22 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.429 HD12 HD13 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.209999999999994 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.239999999999995 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.430000000000007 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 74.430000000000007 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 74.510000000000005 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.540000000000006 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.140000000000001 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.420000000000002 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.219999999999999 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.409999999999997 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.509 ' HZ2' ' HB2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.450000000000003 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 52.350000000000001 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.485 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.430000000000007 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.200000000000003 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.409999999999997 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 74.530000000000001 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.411 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 74.120000000000005 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 74.200000000000003 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.435 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 74.549999999999997 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.42 ' HB3' HD11 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.520000000000003 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.239999999999995 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.349999999999994 110.405 171.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 169.69 126.5 0.86 Allowed Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.450000000000003 111.579 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -66.07 95.09 0.26 Allowed 'General case' 0 C--N 1.359 0.997 0 CA-C-N 117.794 0.797 . . . . 74.450000000000003 109.429 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -147.51 161.04 41.9 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.511 -0.768 . . . . 74.420000000000002 109.374 -173.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.3 108.95 3.4 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 107.797 -1.186 . . . . 75.420000000000002 107.797 169.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.42 HD11 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm -88.16 133.26 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 122.905 0.482 . . . . 74.519999999999996 110.233 -173.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . 0.483 ' HA ' ' HB2' ' A' ' 102' ' ' LEU . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 75.209999999999994 111.212 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.120000000000005 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 72.200000000000003 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.120000000000005 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.230000000000004 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.310000000000002 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.239999999999995 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 72.310000000000002 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.485 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.439999999999998 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.445 HG22 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.549999999999997 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 75.310000000000002 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.471 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 72.340000000000003 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.6 -168.74 48.19 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 71.219999999999999 114.984 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -97.74 135.2 39.87 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.011 0.925 . . . . 75.510000000000005 110.999 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 88' ' ' ASN . 45.2 tp -82.72 104.67 13.14 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.037 -1.097 . . . . 64.450000000000003 108.037 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -68.79 150.07 48.26 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 122.886 0.474 . . . . 75.239999999999995 110.233 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -68.9 83.16 0.22 Allowed Glycine 0 C--N 1.349 1.303 0 O-C-N 123.495 0.497 . . . . 75.329999999999998 112.158 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.3 m -73.7 87.71 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 CA-C-O 122.052 0.929 . . . . 62.200000000000003 110.305 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.963 0 CA-C-N 114.786 -1.097 . . . . 74.349999999999994 110.753 -176.029 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 ttp . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.475 -0.194 . . . . 75.010000000000005 110.475 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -133.9 114.67 13.55 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.221 1.008 . . . . 72.0 108.439 172.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -74.11 83.24 1.8 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.123 0.487 . . . . 72.420000000000002 110.49 -178.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -148.83 129.34 13.95 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.297 -1.001 . . . . 71.310000000000002 108.297 173.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.702 ' HB3' ' HB3' ' A' ' 8' ' ' ARG . 82.7 m-70 -85.8 112.69 21.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.263 -0.643 . . . . 74.040000000000006 109.263 -177.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -72.77 90.06 1.39 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.828 0.451 . . . . 64.319999999999993 110.065 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t-80 57.95 30.55 19.33 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.759 1.224 . . . . 62.43 111.613 174.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.702 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 8.1 tpm_? -92.31 107.73 19.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.689 0.796 . . . . 64.510000000000005 110.045 -176.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.0 t -128.65 176.65 7.62 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.066 0.946 . . . . 71.439999999999998 108.544 172.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.5 22.56 0.74 Allowed Glycine 0 C--N 1.337 0.631 0 N-CA-C 112.1 -0.4 . . . . 63.539999999999999 112.1 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -85.29 148.94 25.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.686 0.394 . . . . 75.430000000000007 110.337 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.582 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 73.239999999999995 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.200000000000003 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.493 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 36.6 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.430000000000007 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 74.310000000000002 108.56 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.340000000000003 108.307 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.450000000000003 110.062 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.426 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p -96.54 110.17 22.61 Favored 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.340000000000003 108.214 172.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.8 t 173.23 149.83 0.07 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.869 1.668 . . . . 71.239999999999995 107.687 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.73 68.9 10.59 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.817 0.818 . . . . 75.25 109.224 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -155.41 119.32 0.91 Allowed Glycine 0 C--N 1.345 1.04 0 N-CA-C 109.734 -1.346 . . . . 51.149999999999999 109.734 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -73.71 85.74 1.65 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.663 0.744 . . . . 73.5 111.227 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.2 t -122.23 139.18 54.08 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.949 -1.13 . . . . 74.120000000000005 107.949 170.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -62.33 134.94 57.18 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.324 0.65 . . . . 74.319999999999993 111.322 -175.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.17 108.34 6.91 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.124 -1.065 . . . . 73.400000000000006 108.124 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.493 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 -58.27 110.36 0.94 Allowed 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.417 1.073 . . . . 75.129999999999995 111.18 -170.588 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 74.5 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.209999999999994 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.510000000000005 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 73.319999999999993 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.568 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.420000000000002 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 75.200000000000003 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.099999999999994 110.147 172.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.568 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 74.019999999999996 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.491 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 75.230000000000004 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 75.5 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.099999999999994 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.430000000000007 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.445 HD22 HD12 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 74.219999999999999 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.509999999999998 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.239999999999995 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.41 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 74.239999999999995 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 74.450000000000003 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 72.510000000000005 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.42 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 64.519999999999996 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 73.340000000000003 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.010000000000005 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.120000000000005 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.42 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 3.9 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.219999999999999 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 62.119999999999997 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.340000000000003 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 70.430000000000007 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.230000000000004 109.517 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 72.239999999999995 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.58 ' HB ' HD22 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 62.020000000000003 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.439999999999998 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.491 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.510000000000005 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.582 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 74.340000000000003 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.5 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 71.510000000000005 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 74.510000000000005 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.549999999999997 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.439999999999998 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 75.519999999999996 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.5 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 65.439999999999998 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 74.019999999999996 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.496 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 72.109999999999999 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 74.340000000000003 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 73.019999999999996 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.402 ' O ' HD12 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.129999999999995 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 73.140000000000001 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 72.109999999999999 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.58 HD22 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.530000000000001 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.402 HD12 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 74.209999999999994 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.230000000000004 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.513 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.040000000000006 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 73.239999999999995 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 72.310000000000002 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.430000000000007 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 64.109999999999999 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.13 113.73 0.58 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.409999999999997 109.444 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -78.58 74.33 5.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.695 0.798 . . . . 74.209999999999994 110.53 -169.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -147.11 178.33 8.46 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.144 1.377 . . . . 75.200000000000003 108.66 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -75.76 134.53 40.43 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.72 -0.845 . . . . 73.420000000000002 108.72 172.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm -107.01 147.44 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.13 0.572 . . . . 75.219999999999999 110.094 -173.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.420000000000002 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 60.119999999999997 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 75.109999999999999 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.230000000000004 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 73.140000000000001 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.140000000000001 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.209999999999994 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.299999999999997 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 75.219999999999999 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 61.149999999999999 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 62.109999999999999 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.200000000000003 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 76.5 -164.13 53.18 Favored Glycine 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.200000000000003 112.975 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -111.94 155.76 23.19 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.425 0.69 . . . . 72.120000000000005 110.155 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.46 102.55 3.83 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.102 -1.073 . . . . 73.430000000000007 108.102 173.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -85.83 89.9 7.9 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.02 -0.991 . . . . 74.299999999999997 109.0 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 70.06 -106.83 1.94 Allowed Glycine 0 C--N 1.345 1.071 0 CA-C-N 115.514 -0.766 . . . . 60.399999999999999 111.313 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.9 p -143.73 156.7 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.222 1.009 . . . . 62.409999999999997 109.209 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 123.358 0.663 . . . . 71.25 109.255 173.22 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.43 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.351 -0.24 . . . . 64.109999999999999 110.351 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -80.42 -25.39 39.04 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.604 0.362 . . . . 74.329999999999998 110.412 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -74.08 81.49 1.75 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 107.909 -1.145 . . . . 73.25 107.909 173.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -92.93 106.64 18.57 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.023 -1.103 . . . . 63.450000000000003 108.023 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -61.99 132.39 52.77 Favored 'General case' 0 C--O 1.244 0.775 0 O-C-N 123.458 0.474 . . . . 74.25 110.172 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -86.9 89.03 7.84 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.046 -0.724 . . . . 74.129999999999995 109.046 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -70.32 89.5 0.67 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 108.836 -0.802 . . . . 74.109999999999999 108.836 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.4 ttt-85 -74.19 79.97 1.79 Allowed 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.798 0.808 . . . . 73.409999999999997 109.086 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.4 t -164.84 169.6 16.44 Favored 'General case' 0 C--O 1.252 1.199 0 CA-C-N 114.432 -1.258 . . . . 65.040000000000006 108.353 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.43 ' HA3' ' NE ' ' A' ' 63' ' ' ARG . . . 171.52 60.99 0.04 OUTLIER Glycine 0 CA--C 1.502 -0.728 0 CA-C-N 115.505 -0.77 . . . . 54.299999999999997 111.196 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -63.43 143.78 57.52 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.314 0.646 . . . . 74.400000000000006 109.969 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 74.439999999999998 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 72.319999999999993 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 74.310000000000002 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.433 ' HG2' HG22 ' A' ' 28' ' ' THR . 24.2 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 74.209999999999994 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.45 ' ND2' ' HB2' ' A' ' 20' ' ' CYS . 23.4 p-10 -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.140000000000001 109.902 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 33.2 m -95.41 110.27 22.33 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.340000000000003 107.281 163.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.548 ' HG ' HG23 ' A' ' 24' ' ' THR . 44.0 t -109.16 112.11 24.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.226 0.61 . . . . 73.239999999999995 109.539 -176.637 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -75.89 82.2 2.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 74.420000000000002 109.449 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.67 -151.06 10.89 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.405 -0.816 . . . . 74.409999999999997 111.713 -176.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -105.02 -26.27 12.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.088 0.555 . . . . 74.25 110.523 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.548 HG23 ' HG ' ' A' ' 20' ' ' CYS . 5.2 t -71.29 111.99 7.06 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-O 121.232 0.539 . . . . 72.439999999999998 109.601 175.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -146.07 3.83 0.94 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.62 0.768 . . . . 75.299999999999997 109.455 178.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.71 52.3 1.49 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.549 1.54 . . . . 74.209999999999994 109.916 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.673 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 -80.14 50.86 1.29 Allowed 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.173 0.989 . . . . 74.510000000000005 110.895 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.433 HG22 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.340000000000003 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.230000000000004 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.455 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 75.129999999999995 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.310000000000002 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 73.430000000000007 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.400000000000006 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.430000000000007 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.519999999999996 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 73.450000000000003 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 73.420000000000002 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.427 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 75.310000000000002 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.340000000000003 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.535 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.129999999999995 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.230000000000004 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.010000000000005 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.349999999999994 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.520000000000003 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.420000000000002 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 74.0 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 75.420000000000002 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.420000000000002 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.230000000000004 110.594 176.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 75.150000000000006 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.219999999999999 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 74.140000000000001 110.002 174.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 74.099999999999994 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 73.549999999999997 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.439999999999998 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.400000000000006 110.385 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 74.010000000000005 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.495 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 71.510000000000005 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 71.109999999999999 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB2' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.645 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.420000000000002 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.010000000000005 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 72.430000000000007 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.510000000000005 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.549999999999997 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.554 ' HA ' ' HB2' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.150000000000006 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 73.349999999999994 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.51 ' HZ2' ' HB2' ' A' ' 70' ' ' LYS . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.329999999999998 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.495 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.129999999999995 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 45.409999999999997 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.329999999999998 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 74.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.457 HD11 HD21 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.319999999999993 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.541 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.120000000000005 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 75.310000000000002 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.535 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.209999999999994 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 75.120000000000005 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 72.25 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.030000000000001 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.239999999999995 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 161.8 84.08 0.05 OUTLIER Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 70.030000000000001 110.797 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -69.98 98.48 1.29 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.155 0.502 . . . . 75.5 110.562 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -120.51 -67.25 0.99 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 106.873 -1.528 . . . . 73.120000000000005 106.873 169.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -153.18 150.53 29.13 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.058 -1.09 . . . . 73.530000000000001 108.058 172.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.541 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm -116.49 110.67 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 74.510000000000005 109.562 -174.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.209999999999994 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 74.109999999999999 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.439999999999998 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.400000000000006 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.409999999999997 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.129999999999995 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.645 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.209999999999994 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.230000000000004 111.143 -176.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.439 HG23 ' HB1' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 74.540000000000006 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.219999999999999 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 73.030000000000001 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.319999999999993 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -83.16 169.36 47.89 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 74.219999999999999 111.698 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.84 146.85 29.66 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.669 0.788 . . . . 73.209999999999994 110.181 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -76.58 159.6 30.17 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.64 -0.709 . . . . 74.319999999999993 109.497 172.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.87 -25.06 68.11 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.496 0.718 . . . . 63.420000000000002 110.96 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.35 143.89 4.74 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.808 -0.633 . . . . 54.450000000000003 112.782 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 42.9 t -74.38 87.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.723 -0.843 . . . . 73.219999999999999 108.723 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 123.989 0.916 . . . . 72.409999999999997 109.681 -178.609 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ppp? . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 119.76 -0.162 . . . . 63.520000000000003 111.39 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.28 85.3 1.42 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.318 0.647 . . . . 64.150000000000006 110.488 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -158.68 128.58 5.82 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.648 -0.705 . . . . 71.5 109.975 174.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -141.85 170.38 15.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.734 1.213 . . . . 72.409999999999997 108.711 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -74.38 111.38 9.5 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 109.601 -0.518 . . . . 72.510000000000005 109.601 177.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -79.41 149.97 31.46 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.62 0.768 . . . . 74.239999999999995 110.157 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -86.58 53.53 2.84 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.115 0.966 . . . . 74.519999999999996 108.881 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 55.54 80.57 0.13 Allowed 'General case' 0 C--N 1.359 1.012 0 C-N-CA 124.453 1.101 . . . . 73.439999999999998 109.962 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 m -56.1 116.41 3.0 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.612 0.765 . . . . 74.439999999999998 111.809 -172.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.22 83.57 0.74 Allowed Glycine 0 C--N 1.346 1.089 0 N-CA-C 110.083 -1.207 . . . . 53.119999999999997 110.083 171.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -60.93 129.2 40.26 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.788 . . . . 74.129999999999995 111.987 -172.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.463 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 74.230000000000004 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 64.299999999999997 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 72.319999999999993 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.430000000000007 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.310000000000002 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 64.420000000000002 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.240000000000002 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.478 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p -96.94 117.19 30.6 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 65.019999999999996 108.893 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -160.19 -169.36 2.46 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.313 1.045 . . . . 75.200000000000003 108.642 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -70.61 159.81 33.69 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 109.135 -0.691 . . . . 75.400000000000006 109.135 168.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.66 -149.95 0.28 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 119.921 -0.377 . . . . 73.420000000000002 112.249 172.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 65.6 5.5 3.32 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.675 0.79 . . . . 75.310000000000002 111.824 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.417 HG21 HE22 ' A' ' 51' ' ' GLN . 39.4 p -132.23 177.73 7.35 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.623 1.169 . . . . 73.5 109.754 -170.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -118.31 164.01 15.84 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.914 0.486 . . . . 74.209999999999994 111.056 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -112.64 160.87 17.45 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.147 -0.933 . . . . 75.5 109.723 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 -102.49 116.92 33.61 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.625 0.37 . . . . 63.229999999999997 111.814 -169.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.200000000000003 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 75.530000000000001 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.400000000000006 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.531 HG22 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.329999999999998 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 55.420000000000002 109.638 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 72.420000000000002 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.299999999999997 111.177 179.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 63.049999999999997 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.531 ' HB2' HG22 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.409999999999997 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.540000000000006 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.140000000000001 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.239999999999995 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HA ' HD22 ' A' ' 44' ' ' LEU . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 64.310000000000002 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 75.239999999999995 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 72.409999999999997 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 64.129999999999995 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 72.140000000000001 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 72.310000000000002 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 71.519999999999996 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 75.109999999999999 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 75.109999999999999 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 74.129999999999995 111.931 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.417 HE22 HG21 ' A' ' 24' ' ' THR . 17.3 mm100 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.140000000000001 112.726 -175.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.329999999999998 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.140000000000001 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 72.209999999999994 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.439999999999998 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 64.299999999999997 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 72.140000000000001 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 74.400000000000006 109.312 177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 75.120000000000005 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 75.340000000000003 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.463 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.329999999999998 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.230000000000004 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 74.420000000000002 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.129999999999995 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 75.239999999999995 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 72.099999999999994 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.349999999999994 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.310000000000002 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.299999999999997 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 74.239999999999995 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.420000000000002 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.424 ' O ' HD11 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 72.150000000000006 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 65.340000000000003 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.150000000000006 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.340000000000003 111.496 -178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.511 HD13 HG23 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.450000000000003 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 74.349999999999994 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.039999999999999 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.340000000000003 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.340000000000003 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.129999999999995 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.54 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 75.450000000000003 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -167.08 89.37 0.1 OUTLIER Glycine 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 72.319999999999993 110.638 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -69.31 85.88 0.4 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.881 0.872 . . . . 74.349999999999994 110.233 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -143.39 -168.24 2.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.488 1.515 . . . . 64.519999999999996 108.319 -177.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.18 139.99 48.52 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.096 -0.705 . . . . 73.420000000000002 109.096 169.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm -112.16 125.99 69.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.753 0.821 . . . . 72.209999999999994 109.444 -172.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.129999999999995 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.511 HG23 HD13 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.140000000000001 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.219999999999999 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.439999999999998 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.040000000000006 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.310000000000002 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.439999999999998 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.230000000000004 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 74.409999999999997 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.200000000000003 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 75.230000000000004 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.140000000000001 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.2 -134.19 24.77 Favored Glycine 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.299999999999997 113.752 172.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -146.61 135.13 22.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.425 0.69 . . . . 72.549999999999997 109.589 -172.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -77.87 104.85 8.68 Favored 'General case' 0 C--N 1.35 0.589 0 C-N-CA 122.945 0.498 . . . . 75.340000000000003 109.789 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.43 -26.8 64.79 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.846 -0.615 . . . . 75.150000000000006 110.748 173.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.95 150.94 7.49 Favored Glycine 0 C--N 1.352 1.431 0 CA-C-N 115.919 -0.582 . . . . 72.450000000000003 111.918 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.9 m -89.56 140.6 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.776 0.43 . . . . 74.340000000000003 110.06 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 123.217 0.607 . . . . 71.430000000000007 109.688 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 109.086 -0.709 . . . . 65.349999999999994 109.086 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.6 p80 -114.45 172.32 7.09 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.059 0.944 . . . . 75.420000000000002 109.979 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -140.48 166.21 25.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.6 0.76 . . . . 74.5 110.189 176.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.64 126.23 27.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.431 1.092 . . . . 64.430000000000007 110.525 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -72.68 95.09 1.82 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.355 0.662 . . . . 73.409999999999997 109.893 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -123.21 -62.86 1.3 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.791 0.837 . . . . 73.409999999999997 109.229 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.9 p80 -99.96 17.73 20.22 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.536 0.734 . . . . 65.140000000000001 109.996 173.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 mtp85 -120.58 119.73 33.74 Favored 'General case' 0 C--N 1.352 0.679 0 C-N-CA 123.723 0.809 . . . . 73.430000000000007 110.561 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 t -162.35 159.7 25.68 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 125.185 1.394 . . . . 55.219999999999999 108.561 174.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.519 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 101.0 -32.7 7.15 Favored Glycine 0 C--N 1.342 0.862 0 CA-C-O 119.809 -0.439 . . . . 54.039999999999999 112.572 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -59.75 127.71 33.31 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.237 0.615 . . . . 72.409999999999997 109.604 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 71.420000000000002 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.450000000000003 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 75.140000000000001 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 75.099999999999994 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.53 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 24.9 t-20 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.150000000000006 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.239999999999995 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.349999999999994 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p -93.11 111.75 23.48 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 64.519999999999996 108.836 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.7 t -165.69 165.05 18.92 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 125.122 1.369 . . . . 75.219999999999999 108.599 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -89.86 -25.24 21.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.999 0.519 . . . . 63.299999999999997 110.139 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.96 97.75 2.19 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.789 -0.524 . . . . 74.120000000000005 111.789 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -69.35 109.33 4.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.538 0.735 . . . . 74.510000000000005 110.313 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.493 HG22 ' HG3' ' A' ' 51' ' ' GLN . 63.4 p -77.43 -166.12 0.7 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.997 0.919 . . . . 72.540000000000006 109.843 173.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -61.98 -70.5 0.19 Allowed 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.816 -0.438 . . . . 65.019999999999996 109.816 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -177.88 178.21 0.99 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.504 1.122 . . . . 73.230000000000004 109.622 171.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.53 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 -132.24 23.09 4.46 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.089 0.955 . . . . 72.329999999999998 110.141 -177.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.349999999999994 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.109999999999999 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 74.349999999999994 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.230000000000004 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.430000000000007 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.436 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 74.25 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.239999999999995 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.420000000000002 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.409999999999997 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 71.319999999999993 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 75.400000000000006 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.310000000000002 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.549999999999997 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.452 ' HB3' HG22 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.430000000000007 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 72.349999999999994 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.439999999999998 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 73.319999999999993 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' O ' HD22 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 74.319999999999993 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.530000000000001 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.340000000000003 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 74.230000000000004 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.230000000000004 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 74.140000000000001 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' HG3' HG22 ' A' ' 24' ' ' THR . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.439999999999998 108.403 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.329999999999998 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 63.310000000000002 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 73.299999999999997 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 71.340000000000003 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.456 ' HB3' HD22 ' A' ' 16' ' ' ASN . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 64.120000000000005 108.186 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.019999999999996 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.420000000000002 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 65.519999999999996 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.019999999999996 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 74.230000000000004 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 70.310000000000002 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.519 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.530000000000001 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 64.310000000000002 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.435 ' HZ3' ' HG2' ' A' ' 69' ' ' GLU . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 73.209999999999994 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.140000000000001 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 74.430000000000007 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 75.319999999999993 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.435 ' HG2' ' HZ3' ' A' ' 65' ' ' LYS . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 75.120000000000005 112.029 178.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.099999999999994 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 72.140000000000001 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.140000000000001 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.120000000000005 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.129999999999995 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.5 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.567 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.510000000000005 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.319999999999993 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.452 HG22 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.319999999999993 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.120000000000005 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 74.420000000000002 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 72.5 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.402 HD22 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.530000000000001 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.09 123.64 1.27 Allowed Glycine 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.040000000000006 111.368 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -74.57 2.5 9.59 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.698 0.799 . . . . 72.349999999999994 112.67 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.531 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -74.03 162.86 28.58 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.389 0.676 . . . . 74.25 110.19 173.248 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.99 149.34 32.32 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.366 0.667 . . . . 73.340000000000003 110.963 174.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm -105.31 149.45 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.025 0.53 . . . . 71.319999999999993 109.835 -177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 74.120000000000005 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.567 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.530000000000001 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.129999999999995 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 72.0 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 72.099999999999994 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 73.209999999999994 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.030000000000001 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.099999999999994 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 73.5 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 74.299999999999997 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.319999999999993 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 70.109999999999999 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 21.2 -94.66 0.01 OUTLIER Glycine 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.430000000000007 115.871 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.531 ' NE2' ' HB3' ' A' ' 85' ' ' ASN . 7.3 pt20 -155.55 158.7 38.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.667 1.187 . . . . 72.120000000000005 109.982 166.371 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.2 mt -85.51 147.42 26.45 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.507 -0.923 . . . . 73.209999999999994 108.507 167.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.31 -7.81 49.51 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.614 0.766 . . . . 73.409999999999997 112.07 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -160.98 -148.79 5.4 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.865 -0.894 . . . . 74.239999999999995 110.865 171.361 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.1 m -95.1 155.09 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.463 0.705 . . . . 74.450000000000003 109.726 175.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.891 -0.576 . . . . 71.310000000000002 109.983 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.731 -0.47 . . . . 73.049999999999997 109.731 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -124.88 135.61 53.04 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.123 0.969 . . . . 65.120000000000005 109.054 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -65.83 116.4 6.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 123.697 0.623 . . . . 74.230000000000004 109.526 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -66.85 -30.45 70.62 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.438 0.695 . . . . 73.430000000000007 109.452 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.528 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 46.0 p-80 -82.1 88.96 6.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 122.241 1.019 . . . . 75.109999999999999 109.047 174.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -105.43 33.64 3.62 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 108.745 -0.835 . . . . 73.019999999999996 108.745 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 64.44 18.38 11.31 Favored 'General case' 0 CA--C 1.562 1.405 0 C-N-CA 125.292 1.437 . . . . 74.129999999999995 111.272 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -93.55 93.19 7.94 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.188 0.995 . . . . 71.530000000000001 111.132 -177.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.5 t -67.38 148.71 51.26 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.948 0.899 . . . . 64.040000000000006 110.118 170.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 159.3 -109.74 0.41 Allowed Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.586 -0.606 . . . . 73.409999999999997 111.586 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -75.5 116.73 16.53 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.219999999999999 110.642 -175.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.510000000000005 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.019999999999996 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.420000000000002 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.109999999999999 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 71.319999999999993 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.299999999999997 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.606 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 35.7 m-80 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 73.099999999999994 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -92.51 114.0 26.42 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 61.119999999999997 109.317 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.485 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 25.2 p -169.83 -165.27 0.48 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.474 1.11 . . . . 65.019999999999996 108.713 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -63.32 -36.66 84.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 72.549999999999997 110.52 171.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.01 103.03 1.62 Allowed Glycine 0 C--N 1.347 1.187 0 O-C-N 123.432 0.457 . . . . 72.239999999999995 112.357 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -78.36 85.23 4.49 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.096 -1.075 . . . . 75.120000000000005 108.096 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.0 t -81.25 138.3 35.78 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.579 0.704 . . . . 64.430000000000007 111.608 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -138.46 16.52 2.75 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.8 1.64 . . . . 74.209999999999994 107.651 175.189 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -88.73 -36.44 16.14 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.686 -1.143 . . . . 72.519999999999996 111.083 -165.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -79.93 74.13 6.68 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.3 -0.863 . . . . 73.200000000000003 110.491 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.150000000000006 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.120000000000005 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 73.340000000000003 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 72.450000000000003 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.530000000000001 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.427 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.230000000000004 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.340000000000003 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.4 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 71.349999999999994 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.427 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 71.519999999999996 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.209999999999994 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.040000000000006 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 75.140000000000001 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 75.099999999999994 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.310000000000002 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 64.040000000000006 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.425 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 75.439999999999998 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 63.450000000000003 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 75.230000000000004 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.409999999999997 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.425 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 75.519999999999996 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 74.239999999999995 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.230000000000004 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.509999999999998 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.420000000000002 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.606 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.119999999999997 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.555 ' HZ1' ' HB3' ' A' ' 54' ' ' LYS . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.439999999999998 108.32 178.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 74.299999999999997 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 61.420000000000002 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.5 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 71.040000000000006 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.433 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 75.519999999999996 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.319999999999993 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.219999999999999 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' HG21 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 73.340000000000003 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 73.439999999999998 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.109999999999999 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 73.230000000000004 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.420000000000002 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.409999999999997 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.488 ' HA ' HG23 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.240000000000002 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 74.310000000000002 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.450000000000003 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.310000000000002 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.556 ' HB3' HG13 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.530000000000001 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 74.450000000000003 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 74.230000000000004 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.030000000000001 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 71.530000000000001 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.120000000000005 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.46 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 61.109999999999999 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.438 ' HB3' HD13 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.409999999999997 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.019999999999996 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.019999999999996 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.46 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.540000000000006 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.11 110.58 0.31 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 60.539999999999999 110.638 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -74.77 96.54 3.08 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.945 0.498 . . . . 75.140000000000001 110.018 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -163.39 -172.44 2.95 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.002 0.921 . . . . 62.149999999999999 109.068 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.35 108.85 6.45 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.523 -0.547 . . . . 73.519999999999996 109.523 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.438 HD13 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm -86.5 129.43 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.341 0.656 . . . . 73.239999999999995 110.816 -176.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.019999999999996 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 72.040000000000006 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 72.209999999999994 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.299999999999997 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.420000000000002 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 73.340000000000003 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.528 ' HA ' ' HB3' ' A' ' 5' ' ' HIS . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.230000000000004 109.989 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.433 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 70.439999999999998 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.556 HG13 ' HB3' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.049999999999997 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.340000000000003 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 74.319999999999993 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.400000000000006 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.54 153.37 45.93 Favored Glycine 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 75.310000000000002 112.269 175.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -73.56 124.67 26.35 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.818 0.447 . . . . 72.25 110.533 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.93 111.18 6.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 106.965 -1.495 . . . . 73.030000000000001 106.965 168.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.77 126.08 26.16 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.776 0.672 . . . . 75.25 110.942 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.12 -85.1 0.05 OUTLIER Glycine 0 C--N 1.334 0.42 0 N-CA-C 109.334 -1.507 . . . . 72.540000000000006 109.334 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.8 m -122.27 152.81 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.941 0.897 . . . . 72.230000000000004 109.39 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 C--O 1.244 0.808 0 C-N-CA 123.728 0.811 . . . . 63.329999999999998 109.898 -176.151 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtm . . . . . 0 N--CA 1.484 1.225 0 N-CA-C 110.48 -0.193 . . . . 73.420000000000002 110.48 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -148.65 -65.81 0.24 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.111 0.964 . . . . 71.030000000000001 108.565 171.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -82.33 102.74 11.42 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 108.95 -0.759 . . . . 73.230000000000004 108.95 175.503 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -80.38 40.43 0.49 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.672 0.789 . . . . 73.150000000000006 112.697 -174.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -168.89 118.5 0.71 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 106.845 -1.539 . . . . 64.430000000000007 106.845 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -76.39 107.56 8.74 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.87 -0.789 . . . . 74.549999999999997 108.87 177.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -77.51 123.43 26.57 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.685 -0.858 . . . . 74.540000000000006 108.685 171.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -65.66 106.59 1.51 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.944 -0.762 . . . . 74.430000000000007 108.944 170.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.2 t -115.04 23.99 12.07 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.017 1.327 . . . . 75.140000000000001 109.929 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.3 51.88 48.78 Favored Glycine 0 C--N 1.351 1.407 0 N-CA-C 110.615 -0.994 . . . . 72.120000000000005 110.615 -169.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -78.35 135.0 37.39 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.452 0.701 . . . . 71.209999999999994 110.393 -170.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.483 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.040000000000006 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.439999999999998 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 71.109999999999999 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.200000000000003 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.499 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.009999999999998 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.329999999999998 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.409 ' ND2' ' HH ' ' A' ' 27' ' ' TYR . 13.9 m120 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.530000000000001 110.308 -173.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -95.46 109.88 22.01 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 75.319999999999993 108.042 172.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.4 m 177.45 169.92 0.61 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 127.07 2.148 . . . . 74.150000000000006 107.139 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -131.57 145.49 51.74 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.09 0.556 . . . . 73.450000000000003 109.523 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.0 -107.63 0.83 Allowed Glycine 0 C--N 1.343 0.972 0 O-C-N 123.929 0.768 . . . . 65.140000000000001 111.512 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -88.65 38.68 0.88 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.922 0.889 . . . . 73.209999999999994 111.455 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.1 p -80.07 83.04 6.02 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.815 0.817 . . . . 63.399999999999999 111.231 -178.009 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -85.97 132.36 34.09 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.653 -1.24 . . . . 61.240000000000002 107.653 167.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.55 86.81 1.6 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 108.454 -0.943 . . . . 75.530000000000001 108.454 174.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.409 ' HH ' ' ND2' ' A' ' 18' ' ' ASN . 23.1 p90 -77.33 73.3 3.91 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.209999999999994 110.223 -179.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.420000000000002 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.540000000000006 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.430000000000007 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 75.219999999999999 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 74.530000000000001 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.349999999999994 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 73.439999999999998 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 70.109999999999999 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.437 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 74.299999999999997 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.100000000000001 110.771 176.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 75.299999999999997 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.437 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.430000000000007 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.219999999999999 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.41 ' HB3' HG22 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 72.219999999999999 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 75.310000000000002 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.219999999999999 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.319999999999993 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.099999999999994 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.230000000000004 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 75.129999999999995 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.319999999999993 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 73.420000000000002 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 75.409999999999997 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.099999999999994 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 71.109999999999999 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 74.120000000000005 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.140000000000001 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.120000000000005 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 74.030000000000001 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.499 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 74.019999999999996 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.633 ' HB ' HD23 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 74.140000000000001 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 71.430000000000007 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.450000000000003 109.739 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.483 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.219999999999999 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 75.030000000000001 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.532 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.239999999999995 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 70.540000000000006 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.506 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 75.439999999999998 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 74.349999999999994 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 74.420000000000002 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.510000000000005 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.506 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 72.439999999999998 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.099999999999994 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 75.319999999999993 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.505 ' HB2' HG22 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.319999999999993 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 55.210000000000001 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.406 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 74.019999999999996 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.633 HD23 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 74.420000000000002 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 65.239999999999995 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.41 HG22 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.400000000000006 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 74.530000000000001 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 62.109999999999999 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.019999999999996 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.67 -100.99 0.18 Allowed Glycine 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.450000000000003 113.28 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -132.76 171.85 13.33 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.606 0.763 . . . . 74.310000000000002 111.402 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -83.66 -30.96 26.42 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.989 0.916 . . . . 75.319999999999993 111.104 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.1 90.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.222 -0.659 . . . . 71.209999999999994 109.222 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.501 ' HA ' ' HA ' ' A' ' 101' ' ' GLN . 48.2 mm -122.23 144.02 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.208 0.603 . . . . 71.129999999999995 109.595 -176.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.120000000000005 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.534 HG22 HD13 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 74.129999999999995 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 65.109999999999999 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 75.120000000000005 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.340000000000003 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.432 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 65.349999999999994 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.532 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.140000000000001 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.540000000000006 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.505 HG22 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.120000000000005 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.129999999999995 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.417 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.319999999999993 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.519999999999996 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.24 -176.95 54.54 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.430000000000007 112.736 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.501 ' HA ' ' HA ' ' A' ' 87' ' ' ILE . 3.4 pt20 -134.38 160.5 37.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.025 0.53 . . . . 71.5 110.626 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.1 mt -95.99 103.45 15.33 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.161 -0.681 . . . . 65.340000000000003 109.161 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.739 0.415 . . . . 64.299999999999997 111.154 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -152.83 -167.04 14.98 Favored Glycine 0 C--N 1.345 1.03 0 N-CA-C 111.345 -0.702 . . . . 65.519999999999996 111.345 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.4 t 59.5 98.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 125.043 1.337 . . . . 72.420000000000002 111.106 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 CA--C 1.547 0.847 0 C-N-CA 123.853 0.861 . . . . 74.150000000000006 109.976 -175.989 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.894 0.378 . . . . 65.409999999999997 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -90.38 99.13 12.21 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.916 0.486 . . . . 75.129999999999995 110.022 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -81.1 71.58 8.09 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.199 -1.037 . . . . 73.019999999999996 108.199 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -83.58 118.45 23.82 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.783 -1.099 . . . . 75.510000000000005 109.453 -174.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -78.67 167.72 20.81 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 123.57 0.748 . . . . 75.019999999999996 110.737 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -73.93 103.96 4.62 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.399 -0.818 . . . . 75.409999999999997 108.793 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.6 p-80 -65.63 -34.62 78.64 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.342 0.402 . . . . 73.219999999999999 110.029 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -75.36 96.1 3.34 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.155 -0.929 . . . . 74.340000000000003 108.751 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.9 m -139.7 174.13 10.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.636 1.174 . . . . 60.140000000000001 108.636 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.4 -24.05 67.19 Favored Glycine 0 CA--C 1.533 1.19 0 O-C-N 123.091 0.244 . . . . 74.230000000000004 113.261 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -76.2 161.08 29.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.107 0.963 . . . . 74.299999999999997 112.025 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.495 HG23 HD21 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 73.340000000000003 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 74.540000000000006 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 73.420000000000002 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 74.25 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.319999999999993 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 74.230000000000004 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.412 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.319999999999993 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -95.53 111.2 23.15 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 74.540000000000006 109.546 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 71.4 m -153.61 178.96 9.27 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.077 1.351 . . . . 64.239999999999995 108.68 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -89.63 64.68 6.67 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.444 -0.947 . . . . 72.030000000000001 108.444 172.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -136.6 158.18 23.97 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.081 -0.963 . . . . 65.549999999999997 111.362 -177.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -60.62 -60.95 2.99 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.48 0.712 . . . . 73.140000000000001 112.073 -170.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.0 m -153.53 103.22 2.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.67 0.788 . . . . 73.510000000000005 109.279 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -112.95 89.93 3.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.432 0.693 . . . . 74.420000000000002 109.45 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -137.95 152.43 48.95 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.043 -0.725 . . . . 75.420000000000002 109.043 172.233 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.48 ' HH ' ' HB3' ' A' ' 47' ' ' TYR . 81.4 m-85 -132.19 97.58 4.17 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 74.439999999999998 109.02 -178.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 73.109999999999999 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.239999999999995 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 62.119999999999997 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.427 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.120000000000005 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.239999999999995 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.340000000000003 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 74.030000000000001 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.120000000000005 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.413 ' O ' HG21 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.400000000000006 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.495 HD21 HG23 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.430000000000007 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.435 ' HG2' HD12 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 72.120000000000005 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.129999999999995 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.413 HG21 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.319999999999993 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.545 HD22 HD12 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 73.010000000000005 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.230000000000004 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.150000000000006 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.040000000000006 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.519999999999996 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 72.040000000000006 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.48 ' HB3' ' HH ' ' A' ' 27' ' ' TYR . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 73.239999999999995 111.524 -177.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.449 HG21 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.310000000000002 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 74.340000000000003 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.230000000000004 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.120000000000005 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.119999999999997 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.529 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.530000000000001 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 73.219999999999999 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 73.140000000000001 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.400000000000006 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 74.420000000000002 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 71.120000000000005 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.545 HD12 HD22 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 75.140000000000001 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 73.209999999999994 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 74.540000000000006 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.47 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 72.340000000000003 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 72.439999999999998 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.319999999999993 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.405 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 74.030000000000001 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.129999999999995 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.219999999999999 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 74.319999999999993 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.319999999999993 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.429 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.200000000000003 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.099999999999994 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.435 HD12 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.549999999999997 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 71.120000000000005 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.429 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 74.329999999999998 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.340000000000003 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 75.129999999999995 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.349999999999994 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 75.439999999999998 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 73.219999999999999 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 72.040000000000006 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -140.35 -110.38 0.86 Allowed Glycine 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.130000000000003 112.049 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -138.93 171.08 14.86 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.264 1.026 . . . . 75.340000000000003 110.051 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -75.79 11.49 1.36 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 113.313 0.857 . . . . 74.120000000000005 113.313 -173.354 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' A' ' 101' ' ' GLN . 5.3 m-20 -85.21 25.23 1.01 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.802 0.841 . . . . 72.019999999999996 111.795 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.6 mm -83.41 146.86 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.175 0.99 . . . . 73.239999999999995 109.198 -176.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 73.010000000000005 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 71.109999999999999 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 72.450000000000003 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 74.120000000000005 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.430000000000007 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 55.420000000000002 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.47 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.530000000000001 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.430000000000007 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 72.319999999999993 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 73.239999999999995 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.130000000000003 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.420000000000002 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 60.09 -112.83 4.79 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 75.109999999999999 113.093 176.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 86' ' ' ASP . 16.8 pt20 -158.42 170.1 22.97 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 72.099999999999994 109.915 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.4 tp -102.51 110.67 22.69 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.524 -1.287 . . . . 74.430000000000007 107.524 165.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -91.78 111.25 22.7 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.291 1.037 . . . . 75.25 109.236 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.43 68.21 0.58 Allowed Glycine 0 N--CA 1.475 1.264 0 N-CA-C 111.97 -0.452 . . . . 55.539999999999999 111.97 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.4 p -81.55 124.64 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.332 0.653 . . . . 64.209999999999994 110.552 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 123.77 0.828 . . . . 75.319999999999993 109.355 -179.448 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mmm . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 121.237 0.541 . . . . 61.229999999999997 109.979 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -132.77 -68.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 106.732 -1.581 . . . . 71.420000000000002 106.732 169.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -88.6 90.19 8.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.098 -1.075 . . . . 74.0 108.098 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -74.17 147.52 42.51 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.443 -0.577 . . . . 70.299999999999997 109.443 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -68.51 120.1 14.02 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 122.944 0.498 . . . . 75.129999999999995 111.425 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.518 ' HE2' ' HB3' ' A' ' 63' ' ' ARG . 50.0 t-80 -160.2 108.88 1.7 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.841 0.456 . . . . 53.399999999999999 110.801 -175.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -169.78 55.9 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 107.033 -1.469 . . . . 70.040000000000006 107.033 173.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -171.87 150.32 2.6 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.822 -1.081 . . . . 73.329999999999998 109.971 -172.028 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -79.57 152.23 30.21 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.185 0.594 . . . . 71.109999999999999 110.129 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.01 167.82 29.44 Favored Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.909 -0.476 . . . . 72.349999999999994 111.909 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -77.47 156.34 31.13 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.43 0.692 . . . . 73.329999999999998 110.525 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.537 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.420000000000002 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 70.430000000000007 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.457 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 73.230000000000004 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.310000000000002 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.631 HD22 HD13 ' A' ' 44' ' ' LEU . 15.8 m120 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 70.430000000000007 109.548 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.559 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 75.040000000000006 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.540000000000006 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p -121.23 113.9 20.62 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.239999999999995 110.729 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 53' ' ' CYS . 59.8 m -132.26 158.58 41.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.355 1.462 . . . . 75.549999999999997 108.397 168.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.68 110.32 0.98 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.55 0.74 . . . . 53.119999999999997 111.462 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.13 -99.0 1.77 Allowed Glycine 0 C--N 1.345 1.044 0 CA-C-N 114.828 -1.078 . . . . 62.43 112.207 -178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.461 ' HB2' ' HZ3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -92.05 135.24 34.12 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.696 0.799 . . . . 73.099999999999994 110.765 -174.346 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.1 m -149.73 143.17 25.26 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.747 0.819 . . . . 71.420000000000002 109.478 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -92.28 115.34 28.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.155 0.503 . . . . 75.109999999999999 110.321 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.59 171.43 9.4 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.053 0.941 . . . . 60.43 109.377 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.607 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 -131.15 142.53 50.24 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.146 0.578 . . . . 74.319999999999993 110.758 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 74.209999999999994 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.409999999999997 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.310000000000002 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.515 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 75.340000000000003 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.200000000000003 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.728 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 63.5 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 74.349999999999994 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.109999999999999 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.728 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.430000000000007 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD22 HG22 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.129999999999995 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 73.530000000000001 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.413 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 74.219999999999999 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.010000000000005 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 75.200000000000003 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.120000000000005 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.519999999999996 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.631 HD13 HD22 ' A' ' 16' ' ' ASN . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.099999999999994 110.635 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.464 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 72.25 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.519999999999996 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 73.519999999999996 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.556 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.239999999999995 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.439999999999998 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 70.510000000000005 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.607 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 71.150000000000006 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 72.510000000000005 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.150000000000006 108.747 172.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.209999999999994 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 74.510000000000005 110.121 -172.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.319999999999993 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.596 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.409999999999997 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 73.109999999999999 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.349999999999994 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 74.340000000000003 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.537 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 74.209999999999994 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.340000000000003 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.613 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.109999999999999 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 73.439999999999998 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 74.530000000000001 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 63.340000000000003 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 75.409999999999997 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 73.150000000000006 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.129999999999995 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 73.349999999999994 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.400000000000006 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 64.430000000000007 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 74.510000000000005 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.409999999999997 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.564 HD12 HG23 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 73.120000000000005 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.495 ' HD2' HG21 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 73.099999999999994 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.464 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.209999999999994 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.442 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.510000000000005 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.150000000000006 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.030000000000001 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 74.010000000000005 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.59 99.66 0.17 Allowed Glycine 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.340000000000003 111.11 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -80.66 6.92 11.37 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.33 0.652 . . . . 72.230000000000004 112.2 -176.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -67.42 -84.69 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.732 0.813 . . . . 74.530000000000001 110.725 -178.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.589 ' HB2' ' HB3' ' A' ' 101' ' ' GLN . 15.6 m-20 -151.4 130.83 12.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 71.310000000000002 108.753 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.507 HG22 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm -115.84 133.16 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.554 0.741 . . . . 75.450000000000003 109.023 -178.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.530000000000001 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.564 HG23 HD12 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 74.219999999999999 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 72.040000000000006 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.230000000000004 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.319999999999993 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.409999999999997 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 63.409999999999997 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 75.040000000000006 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 62.350000000000001 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.420000000000002 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 75.430000000000007 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.596 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 128.89 -160.16 22.34 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 64.140000000000001 110.66 -178.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.589 ' HB3' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -131.16 143.69 50.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.418 -1.327 . . . . 70.409999999999997 107.418 175.347 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -66.22 123.92 21.25 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.722 -0.844 . . . . 73.310000000000002 108.722 174.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 75.35 -7.53 1.76 Allowed 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 125.345 1.458 . . . . 74.430000000000007 111.961 -177.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -94.24 72.76 1.13 Allowed Glycine 0 C--N 1.357 1.717 0 C-N-CA 123.207 0.432 . . . . 64.230000000000004 112.318 -176.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 29.2 m -105.57 140.14 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.651 0.78 . . . . 74.530000000000001 109.929 175.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 122.804 0.442 . . . . 71.120000000000005 110.171 -178.064 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.487 -0.56 . . . . 74.109999999999999 109.487 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.68 141.82 32.16 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.023 0.529 . . . . 73.420000000000002 109.574 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -55.54 122.0 10.31 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.285 1.034 . . . . 73.239999999999995 109.615 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -46.51 -43.79 17.14 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.452 1.101 . . . . 75.409999999999997 112.719 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 61.96 84.29 0.14 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.508 1.13 . . . . 72.400000000000006 110.222 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -73.52 86.46 1.57 Allowed 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.268 0.556 . . . . 74.319999999999993 109.682 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.512 ' HD1' ' HB3' ' A' ' 9' ' ' SER . 5.8 p80 -78.82 131.28 36.43 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.449 -0.796 . . . . 71.299999999999997 109.569 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -81.65 75.23 8.6 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.584 0.754 . . . . 64.230000000000004 109.42 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.512 ' HB3' ' HD1' ' A' ' 7' ' ' HIS . 29.5 t -168.02 178.55 5.05 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.06 -1.427 . . . . 70.230000000000004 108.696 -175.435 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.42 ' H ' ' NH2' ' A' ' 63' ' ' ARG . . . 91.98 -38.95 3.09 Favored Glycine 0 N--CA 1.471 1.015 0 N-CA-C 110.991 -0.844 . . . . 64.209999999999994 110.991 -170.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.39 149.75 32.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.224 1.41 . . . . 65.140000000000001 111.133 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.432 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.210000000000001 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 73.430000000000007 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.414 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.519999999999996 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 65.299999999999997 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.424 HD22 HD23 ' A' ' 44' ' ' LEU . 13.9 m120 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.299999999999997 109.827 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.209999999999994 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.340000000000003 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.505 ' HG1' ' HB2' ' A' ' 54' ' ' LYS . 24.8 p -98.81 105.82 18.01 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.129999999999995 108.419 171.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.4 m -167.82 -164.44 0.56 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.662 1.185 . . . . 74.340000000000003 108.918 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -72.58 -33.15 66.56 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.912 0.485 . . . . 71.450000000000003 110.587 170.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.76 62.78 3.26 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.644 -0.582 . . . . 62.520000000000003 111.644 -179.412 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.687 ' HZ3' ' HA ' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -60.03 -40.58 89.81 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.089 0.955 . . . . 72.25 110.763 -178.896 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.9 m -98.15 -88.91 0.31 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.831 -0.803 . . . . 74.140000000000001 108.831 171.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -176.3 167.86 2.82 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.886 0.874 . . . . 74.109999999999999 109.171 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -66.53 99.23 0.56 Allowed 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.349 -0.982 . . . . 74.450000000000003 108.349 166.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.458 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 -63.02 108.85 1.31 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.579 1.152 . . . . 73.340000000000003 111.703 -161.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.450000000000003 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.414 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.430000000000007 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 70.109999999999999 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.540000000000006 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 74.219999999999999 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.519999999999996 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 72.120000000000005 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.329999999999998 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.049999999999997 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 71.129999999999995 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.540000000000006 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 72.030000000000001 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.120000000000005 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.109999999999999 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.519999999999996 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.424 HD23 HD22 ' A' ' 16' ' ' ASN . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 73.349999999999994 110.649 -173.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 72.030000000000001 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 74.019999999999996 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.458 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.229999999999997 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.420000000000002 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 74.040000000000006 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.049999999999997 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 73.030000000000001 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 74.010000000000005 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.519999999999996 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.505 ' HB2' ' HG1' ' A' ' 19' ' ' THR . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.209999999999994 108.027 172.629 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.510000000000005 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 75.349999999999994 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.450000000000003 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 175.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 72.140000000000001 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 75.109999999999999 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.432 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 71.239999999999995 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 73.319999999999993 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.539 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 75.219999999999999 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.510000000000005 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.519999999999996 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 74.299999999999997 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.439999999999998 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.230000000000004 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 75.140000000000001 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 74.319999999999993 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.340000000000003 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.340000000000003 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.439999999999998 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 72.049999999999997 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 74.129999999999995 111.367 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.534 HD13 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.099999999999994 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 74.109999999999999 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.409 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 73.209999999999994 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.239999999999995 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.505 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 73.239999999999995 110.502 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.430000000000007 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 75.329999999999998 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -161.79 -101.36 0.16 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.340000000000003 112.722 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.505 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 30.8 m-85 -101.65 148.61 25.04 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.957 0.903 . . . . 72.129999999999995 110.161 -170.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -71.26 -27.69 63.62 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 120.852 0.358 . . . . 62.409999999999997 110.587 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.34 114.35 26.12 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.845 -0.798 . . . . 74.310000000000002 108.845 174.372 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.433 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm -129.13 147.98 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.992 . . . . 64.239999999999995 109.392 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 65.099999999999994 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.534 ' HB ' HD13 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 73.140000000000001 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 73.040000000000006 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.430000000000007 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 71.239999999999995 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.209999999999994 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.539 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.010000000000005 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 65.549999999999997 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 75.120000000000005 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 64.140000000000001 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.329999999999998 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.439999999999998 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.53 -170.11 49.97 Favored Glycine 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 61.340000000000003 113.181 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -118.56 139.87 50.79 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.68 0.792 . . . . 74.519999999999996 109.4 176.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.17 102.07 2.43 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.287 0.635 . . . . 70.040000000000006 109.768 -176.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.43 -48.16 82.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.101 0.561 . . . . 74.209999999999994 109.515 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.33 -158.22 35.47 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-N 115.224 -0.898 . . . . 75.040000000000006 113.878 176.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.2 m -115.85 162.01 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.813 0.845 . . . . 73.209999999999994 109.675 174.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 C--O 1.256 1.404 0 CA-C-O 118.615 -0.707 . . . . 74.319999999999993 109.158 -178.747 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.483 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 108.893 -0.78 . . . . 64.140000000000001 108.893 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -88.61 96.25 10.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.365 0.666 . . . . 75.329999999999998 109.486 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -127.5 15.26 7.11 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.696 0.798 . . . . 74.439999999999998 111.517 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -61.87 138.05 58.31 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.299 -0.63 . . . . 75.099999999999994 109.299 175.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -68.74 81.25 0.28 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 123.77 0.669 . . . . 71.219999999999999 109.502 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -78.55 108.79 12.2 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 109.12 -0.696 . . . . 74.299999999999997 109.12 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -119.46 141.55 49.05 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.98 0.912 . . . . 73.049999999999997 109.054 175.175 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -165.57 -87.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 O-C-N 124.452 1.095 . . . . 73.109999999999999 108.974 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t 164.54 149.16 0.02 OUTLIER 'General case' 0 C--O 1.245 0.823 0 C-N-CA 125.793 1.637 . . . . 74.120000000000005 106.784 -170.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.4 9.32 64.3 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 123.059 0.224 . . . . 73.329999999999998 113.62 -176.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -65.89 134.05 52.2 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.420000000000002 108.232 171.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.584 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 74.310000000000002 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.129999999999995 108.841 177.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.210000000000001 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 74.200000000000003 108.46 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 70.400000000000006 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 73.319999999999993 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.510000000000005 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.427 ' HG1' ' HB3' ' A' ' 55' ' ' ARG . 40.2 p -125.92 109.27 12.28 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.450000000000003 110.085 -175.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 54' ' ' LYS . 65.6 m -166.56 124.21 1.36 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.099 1.76 . . . . 75.109999999999999 107.337 177.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -62.28 101.62 0.24 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.087 0.555 . . . . 73.040000000000006 110.747 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.19 134.28 7.93 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 115.564 -0.744 . . . . 73.349999999999994 111.259 -175.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.629 ' HZ2' ' HB2' ' A' ' 23' ' ' LYS . 3.7 ttmp? 66.5 32.22 7.52 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.576 1.15 . . . . 74.219999999999999 110.728 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.3 m -85.9 69.71 10.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.201 -0.909 . . . . 63.229999999999997 109.625 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -87.47 110.42 20.3 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.262 -1.014 . . . . 72.200000000000003 108.262 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.56 56.95 2.49 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 122.05 0.929 . . . . 60.219999999999999 110.867 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -53.94 126.91 24.17 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 114.512 -1.222 . . . . 64.209999999999994 111.081 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 73.540000000000006 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 72.209999999999994 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.019999999999996 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.492 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.450000000000003 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 72.310000000000002 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.662 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.430000000000007 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.219999999999999 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.209999999999994 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.662 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.340000000000003 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 65.319999999999993 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.129999999999995 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.509 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 74.140000000000001 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.109999999999999 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.340000000000003 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.420000000000002 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.150000000000006 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.299999999999997 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 71.430000000000007 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.109999999999999 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.546 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.329999999999998 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.439 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 75.129999999999995 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 74.409999999999997 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 73.230000000000004 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.546 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 71.099999999999994 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.019999999999996 114.502 172.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 73.540000000000006 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.432 ' N ' ' SG ' ' A' ' 20' ' ' CYS . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 75.530000000000001 111.684 178.906 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HB3' ' HG1' ' A' ' 19' ' ' THR . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 74.430000000000007 108.147 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 72.420000000000002 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.239999999999995 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.514 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.010000000000005 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 75.219999999999999 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 74.019999999999996 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.584 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.310000000000002 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 63.130000000000003 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.454 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.299999999999997 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 74.319999999999993 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 74.549999999999997 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.409999999999997 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.150000000000006 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.329999999999998 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.329999999999998 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.517 ' HB1' HG23 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.230000000000004 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.519999999999996 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.420000000000002 110.467 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.514 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.409999999999997 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.477 HD12 HG23 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 75.209999999999994 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 74.420000000000002 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 71.099999999999994 110.628 177.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.450000000000003 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.109999999999999 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.239999999999995 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.439 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 65.120000000000005 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 142.31 -143.44 12.8 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 73.140000000000001 110.796 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 41.98 71.24 0.22 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.32 1.448 . . . . 74.219999999999999 113.371 170.359 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.13 152.34 26.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.9 -0.591 . . . . 74.400000000000006 109.961 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 62.54 86.56 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.423 1.089 . . . . 75.430000000000007 108.392 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 24.0 mm -84.14 138.12 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 123.544 0.738 . . . . 73.310000000000002 111.551 -171.575 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 74.150000000000006 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.477 HG23 HD12 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.219999999999999 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 65.129999999999995 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.310000000000002 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.129999999999995 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 70.209999999999994 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.517 HG23 ' HB1' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.310000000000002 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.030000000000001 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.040000000000006 108.06 171.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.310000000000002 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 59.9 -128.17 45.82 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.019999999999996 113.47 175.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.83 151.42 37.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.288 0.566 . . . . 74.310000000000002 111.139 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.22 119.84 19.89 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 125.31 1.444 . . . . 75.219999999999999 109.459 177.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.68 88.4 0.7 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 109.152 -0.684 . . . . 73.120000000000005 109.152 172.226 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -153.72 19.18 0.68 Allowed Glycine 0 N--CA 1.468 0.822 0 CA-C-N 114.962 -1.017 . . . . 74.530000000000001 111.972 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.8 t -80.76 92.29 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.548 0 N-CA-C 108.865 -0.791 . . . . 75.209999999999994 108.865 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-N 115.19 -0.914 . . . . 70.25 108.714 -179.297 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 110.008 -0.367 . . . . 74.109999999999999 110.008 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -65.99 98.62 0.44 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.15 0.58 . . . . 74.439999999999998 111.119 -175.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -86.57 125.49 33.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.337 0.655 . . . . 73.319999999999993 109.688 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -86.6 -34.25 19.93 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.642 0.734 . . . . 75.109999999999999 110.043 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -126.37 -169.07 1.95 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.013 1.325 . . . . 74.310000000000002 109.373 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -124.95 81.82 2.0 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.016 0.926 . . . . 74.310000000000002 109.186 174.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m170 73.28 -21.91 0.24 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.558 1.543 . . . . 75.140000000000001 112.714 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 102.59 12.9 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.211 1.004 . . . . 74.030000000000001 109.046 -172.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.8 p -156.9 -78.7 0.08 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.418 0.687 . . . . 71.310000000000002 109.923 174.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.4 ' HA2' ' NH2' ' A' ' 63' ' ' ARG . . . -104.62 21.42 36.76 Favored Glycine 0 C--N 1.357 1.718 0 C-N-CA 123.088 0.375 . . . . 62.509999999999998 113.307 -171.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -78.9 121.92 25.46 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.184 0.594 . . . . 74.140000000000001 109.789 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.319999999999993 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.230000000000004 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 75.150000000000006 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.109999999999999 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.639 HD22 HD22 ' A' ' 44' ' ' LEU . 16.4 m120 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 71.120000000000005 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 73.230000000000004 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 74.219999999999999 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m -106.86 110.81 23.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 65.129999999999995 107.483 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.6 t -169.06 161.01 10.28 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.781 0.832 . . . . 63.509999999999998 109.98 -170.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -74.24 139.42 44.33 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.943 0.497 . . . . 72.340000000000003 109.926 174.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.43 -178.53 34.17 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-N 116.117 -0.492 . . . . 72.439999999999998 111.952 -174.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -74.93 97.94 3.46 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.424 0.689 . . . . 74.450000000000003 109.282 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.8 p -65.86 107.77 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.052 0.941 . . . . 73.400000000000006 110.589 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -69.07 109.15 3.86 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 123.601 0.76 . . . . 74.239999999999995 110.625 -179.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.45 151.86 29.07 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.735 0.814 . . . . 75.319999999999993 110.238 175.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -127.0 109.54 12.01 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.010000000000005 108.333 174.177 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 71.430000000000007 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.319999999999993 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.530000000000001 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.439 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 71.239999999999995 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 73.439999999999998 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.416 HG21 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.209999999999994 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.416 ' H ' HG21 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 72.230000000000004 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.239999999999995 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.439 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 74.310000000000002 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.349999999999994 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 74.439999999999998 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.400000000000006 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 75.120000000000005 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 74.129999999999995 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.040000000000006 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.639 HD22 HD22 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.400000000000006 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.540000000000006 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.340000000000003 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.219999999999999 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.41 HD11 ' ND2' ' A' ' 16' ' ' ASN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.420000000000002 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 74.319999999999993 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 72.040000000000006 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.030000000000001 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.519999999999996 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.450000000000003 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 74.319999999999993 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.200000000000003 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 65.329999999999998 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 74.530000000000001 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 71.319999999999993 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.449 ' O ' ' HA ' ' A' ' 14' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.299999999999997 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 71.25 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.540000000000006 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 71.340000000000003 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.626 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.329999999999998 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.430000000000007 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 74.150000000000006 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 74.099999999999994 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 72.230000000000004 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.409999999999997 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.428 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.409999999999997 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 74.439999999999998 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 64.329999999999998 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 72.109999999999999 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 75.450000000000003 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.437 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.450000000000003 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.553 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 71.409999999999997 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.200000000000003 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.239999999999995 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 74.239999999999995 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.299999999999997 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 71.099999999999994 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 74.129999999999995 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -109.97 -143.33 9.81 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.450000000000003 111.165 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -130.15 -59.58 1.04 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.588 0.755 . . . . 73.519999999999996 109.715 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -153.23 150.22 28.77 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.764 -0.653 . . . . 75.109999999999999 110.036 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 33.7 t70 62.1 106.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.815 1.246 . . . . 75.540000000000006 112.415 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.13 135.36 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 74.319999999999993 108.024 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 75.5 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.553 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 64.239999999999995 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.340000000000003 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.310000000000002 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 73.030000000000001 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 61.32 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.626 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 73.540000000000006 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 75.340000000000003 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 72.099999999999994 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 74.439999999999998 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.437 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.310000000000002 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.420000000000002 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -71.18 175.41 39.33 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.299999999999997 112.499 167.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -103.58 156.87 17.45 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.967 0.729 . . . . 74.340000000000003 112.967 -170.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.3 mt -66.09 147.59 53.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.857 1.263 . . . . 72.420000000000002 111.437 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -80.76 80.82 7.16 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 108.243 -1.021 . . . . 74.219999999999999 108.243 168.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -101.49 123.87 8.05 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.416 -0.811 . . . . 70.420000000000002 111.814 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 72.4 t -81.47 87.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.039 -0.726 . . . . 74.239999999999995 109.039 174.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 124.36 1.064 . . . . 55.409999999999997 110.241 179.288 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 111.692 0.256 . . . . 72.430000000000007 111.692 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -74.78 129.64 38.04 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.304 0.642 . . . . 72.129999999999995 110.877 -179.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -77.74 83.6 4.1 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.544 0.688 . . . . 74.200000000000003 109.749 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -78.4 76.28 4.91 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.697 0.76 . . . . 73.420000000000002 109.729 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -147.0 67.3 1.15 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.271 1.028 . . . . 73.530000000000001 108.916 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -156.31 114.47 3.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.681 0.793 . . . . 74.120000000000005 109.883 177.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -90.33 174.1 7.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 123.642 0.777 . . . . 72.349999999999994 110.575 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -75.18 151.05 38.53 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.345 -1.298 . . . . 74.230000000000004 109.444 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.9 m -109.17 153.48 23.7 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 109.366 -0.605 . . . . 72.140000000000001 109.366 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.612 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 89.72 -27.14 8.28 Favored Glycine 0 C--N 1.342 0.892 0 CA-C-N 116.03 -0.532 . . . . 62.32 113.505 176.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -63.93 145.28 56.12 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 123.697 0.799 . . . . 70.099999999999994 110.799 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.602 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 72.230000000000004 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.099999999999994 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 75.140000000000001 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.509 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.230000000000004 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.049999999999997 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.400000000000006 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.439999999999998 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p -116.27 113.65 23.29 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 74.530000000000001 108.384 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.462 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 72.3 m -149.44 -173.89 4.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.246 0.618 . . . . 73.099999999999994 111.163 -172.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -68.24 -24.28 64.89 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.625 0.77 . . . . 73.439999999999998 112.444 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.45 127.65 8.7 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 111.254 -0.738 . . . . 53.149999999999999 111.254 175.31 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -66.16 -25.48 66.98 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 122.971 0.508 . . . . 63.43 111.301 178.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.7 p -85.46 68.07 10.32 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.75 -0.833 . . . . 72.409999999999997 108.75 171.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -94.66 -27.48 15.85 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.107 -0.952 . . . . 74.510000000000005 110.421 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.95 132.63 34.04 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.258 -0.883 . . . . 73.25 109.576 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -132.87 125.85 30.9 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.409999999999997 108.423 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.240000000000002 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.150000000000006 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.129999999999995 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.413 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.329999999999998 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 73.5 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 73.329999999999998 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.420000000000002 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.340000000000003 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.230000000000004 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.437 HD23 HG23 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 70.030000000000001 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.310000000000002 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.510000000000005 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 71.129999999999995 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.010000000000005 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.239999999999995 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.430000000000007 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.520000000000003 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.219999999999999 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.099999999999994 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 71.540000000000006 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.445 HG21 HD11 ' A' ' 82' ' ' LEU . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 74.299999999999997 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 74.140000000000001 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 75.219999999999999 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.607 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 26.3 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.340000000000003 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 74.450000000000003 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.607 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.219999999999999 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 70.439999999999998 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.329999999999998 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 72.439999999999998 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 74.239999999999995 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.310000000000002 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.509 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.310000000000002 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 73.030000000000001 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.602 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 73.439999999999998 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.109999999999999 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.612 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 74.420000000000002 110.245 -169.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.450000000000003 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.430000000000007 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 73.049999999999997 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 64.019999999999996 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.200000000000003 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.431 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.049999999999997 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.540000000000006 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 75.219999999999999 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.349999999999994 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 75.150000000000006 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.417 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.530000000000001 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.608 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.420000000000002 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.43 ' HD2' HG23 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.099999999999994 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.488 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 73.129999999999995 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 72.349999999999994 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 74.430000000000007 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 75.439999999999998 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.230000000000004 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -142.16 -87.78 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -170.97 172.49 5.47 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.797 0.839 . . . . 75.230000000000004 109.263 -178.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -59.02 164.29 3.05 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 124.321 1.048 . . . . 70.209999999999994 112.178 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 67.37 86.42 0.13 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.232 1.413 . . . . 75.409999999999997 110.184 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.608 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm -119.13 139.36 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.68 0.792 . . . . 72.310000000000002 109.44 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 74.340000000000003 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.508 ' HB ' HG23 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 72.329999999999998 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 74.510000000000005 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 73.340000000000003 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.549999999999997 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.400000000000006 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.319999999999993 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.299999999999997 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 55.039999999999999 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.508 HG23 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 65.120000000000005 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.340000000000003 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 81.4 -175.32 54.48 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.430000000000007 113.508 171.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -98.55 152.34 19.67 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.582 0.753 . . . . 73.409999999999997 109.828 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.2 tp -77.69 109.87 12.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.167 0.587 . . . . 74.340000000000003 111.187 -174.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.79 157.86 28.34 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.196 0.998 . . . . 74.310000000000002 110.232 172.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.69 123.93 1.06 Allowed Glycine 0 C--N 1.343 0.948 0 CA-C-O 119.992 -0.338 . . . . 74.219999999999999 112.521 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.49 148.93 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.517 0.727 . . . . 74.430000000000007 110.745 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.248 0.995 0 N-CA-C 108.783 -0.821 . . . . 72.040000000000006 108.783 178.471 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.428 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.822 0 CA-C-O 121.561 0.696 . . . . 73.230000000000004 109.753 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -87.86 115.76 25.54 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.555 -0.748 . . . . 75.430000000000007 109.373 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -95.28 57.77 2.03 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.547 0.739 . . . . 74.239999999999995 111.55 -175.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 m80 53.55 28.17 7.48 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.46 1.104 . . . . 74.299999999999997 112.504 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.38 83.23 1.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.694 -0.854 . . . . 75.310000000000002 108.694 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -123.28 111.72 16.77 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.544 1.137 . . . . 74.349999999999994 108.976 -171.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -76.16 99.44 4.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.968 -0.753 . . . . 65.349999999999994 108.968 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -60.28 110.7 1.3 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.33 -0.618 . . . . 74.349999999999994 109.33 176.514 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.1 m -74.93 99.78 3.93 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 115.474 -0.785 . . . . 70.420000000000002 110.6 -176.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.11 -21.96 74.02 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.478 -0.783 . . . . 64.239999999999995 111.538 167.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -67.03 165.17 16.24 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 124.555 1.142 . . . . 74.140000000000001 109.905 166.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.435 HG21 HD12 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.219999999999999 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.430000000000007 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.434 HG21 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.400000000000006 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.299999999999997 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.319999999999993 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.310000000000002 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 72.230000000000004 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -145.0 125.5 14.02 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 74.120000000000005 109.986 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.2 t -85.05 -63.45 1.33 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 107.661 -1.237 . . . . 72.299999999999997 107.661 173.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -143.07 -51.59 0.36 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.021 1.328 . . . . 71.150000000000006 107.818 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -111.96 -143.28 9.03 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 114.886 -1.052 . . . . 72.049999999999997 110.901 171.579 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -59.57 135.95 57.83 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.765 0.826 . . . . 71.510000000000005 111.338 -177.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.8 m -143.46 151.94 40.93 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.693 0.797 . . . . 72.319999999999993 109.442 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -59.44 118.13 5.65 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.916 0.886 . . . . 64.439999999999998 111.771 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -93.5 158.75 15.55 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.296 1.038 . . . . 74.120000000000005 110.496 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -121.12 86.37 2.56 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.311 0.644 . . . . 73.140000000000001 109.45 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.439999999999998 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.409999999999997 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.209999999999994 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 72.0 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.209999999999994 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.435 HG23 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.430000000000007 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 73.230000000000004 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.435 ' H ' HG23 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 70.209999999999994 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.400000000000006 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.435 HD12 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.240000000000002 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 73.450000000000003 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.120000000000005 110.879 178.828 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.450000000000003 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 113.309 -170.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 74.010000000000005 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 72.400000000000006 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.349999999999994 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 73.310000000000002 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.109999999999999 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 73.25 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.472 HD12 ' HG ' ' A' ' 56' ' ' SER . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 75.530000000000001 109.359 175.27 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.120000000000005 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.400000000000006 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 75.219999999999999 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 74.099999999999994 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 64.319999999999993 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 74.329999999999998 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.010000000000005 107.851 172.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.472 ' HG ' HD12 ' A' ' 48' ' ' ILE . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 73.120000000000005 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.219999999999999 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 75.450000000000003 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.434 HG12 HG21 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 63.450000000000003 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 74.319999999999993 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 72.239999999999995 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.42 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.400000000000006 113.368 -169.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.549999999999997 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 74.319999999999993 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.030000000000001 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.405 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 64.129999999999995 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 74.5 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.299999999999997 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.405 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 72.420000000000002 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 74.239999999999995 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 71.310000000000002 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 71.329999999999998 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 64.409999999999997 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.431 HD23 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.239999999999995 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.472 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.230000000000004 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.409999999999997 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.466 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 75.0 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . 0.475 ' HB3' HD13 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.219999999999999 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 74.25 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.549999999999997 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 73.530000000000001 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 51.84 -120.09 9.94 Favored Glycine 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.420000000000002 113.44 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 48.7 t80 67.7 -78.52 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.669 1.588 . . . . 63.229999999999997 111.649 174.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -98.17 171.29 8.32 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.229 0.612 . . . . 74.340000000000003 109.568 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.19 156.25 4.27 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.162 1.385 . . . . 75.109999999999999 112.34 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . 0.475 HD13 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm -113.33 107.51 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.530000000000001 107.71 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 72.140000000000001 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.472 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 74.109999999999999 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.219999999999999 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 75.040000000000006 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.439999999999998 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.010000000000005 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.42 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.230000000000004 110.113 176.539 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.439999999999998 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 73.439999999999998 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.549999999999997 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 74.329999999999998 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.430000000000007 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.62 -144.03 0.93 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.020000000000003 113.166 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -74.44 108.78 7.42 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.567 -0.531 . . . . 64.430000000000007 109.567 176.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 46.5 tp -67.8 126.58 29.87 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.358 -0.979 . . . . 53.140000000000001 108.358 172.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.68 -52.35 63.64 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.958 0.786 . . . . 73.310000000000002 111.285 -172.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -71.75 -21.85 78.82 Favored Glycine 0 C--N 1.35 1.346 0 CA-C-O 119.564 -0.576 . . . . 71.530000000000001 113.395 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.8 t 63.07 99.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.161 0 C-N-CA 125.171 1.389 . . . . 73.319999999999993 111.453 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.9 t70 . . . . . 0 C--O 1.251 1.147 0 C-N-CA 123.854 0.862 . . . . 75.109999999999999 109.618 -179.56 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 121.035 0.445 . . . . 74.239999999999995 110.171 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.1 p80 177.81 151.03 0.22 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.205 1.402 . . . . 75.340000000000003 109.136 172.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -67.3 94.65 0.39 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.096 -0.705 . . . . 73.420000000000002 109.096 172.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -73.89 110.2 7.99 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.658 -0.868 . . . . 75.209999999999994 108.658 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -91.36 160.36 15.52 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.658 -0.701 . . . . 63.119999999999997 109.67 173.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -72.19 80.42 0.98 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.261 0.553 . . . . 73.439999999999998 110.636 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -163.28 130.32 3.45 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 124.827 1.251 . . . . 75.349999999999994 107.765 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -92.81 133.89 35.61 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.217 -0.661 . . . . 75.120000000000005 109.217 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 t -100.0 27.24 5.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.937 0.895 . . . . 71.209999999999994 110.054 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.73 50.03 60.78 Favored Glycine 0 C--N 1.35 1.348 0 N-CA-C 110.081 -1.208 . . . . 73.439999999999998 110.081 -169.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -73.22 159.12 33.94 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.938 0.895 . . . . 73.219999999999999 111.925 -166.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.56 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 75.439999999999998 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.100000000000001 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.409999999999997 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.530000000000001 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.46 ' HB2' HD23 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.100000000000001 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 64.420000000000002 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' SG ' ' A' ' 53' ' ' CYS . 85.2 m-20 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.230000000000004 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m -92.5 109.14 20.53 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.530000000000001 108.534 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 26.3 p -168.28 165.57 12.92 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.184 1.394 . . . . 71.510000000000005 108.486 179.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.51 98.9 1.18 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 108.926 -0.768 . . . . 72.439999999999998 108.926 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -139.9 158.5 25.73 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.7 -0.682 . . . . 74.120000000000005 112.011 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -83.19 -76.97 0.26 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 122.981 0.513 . . . . 54.409999999999997 110.05 -172.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.8 p -144.06 97.51 3.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.366 1.066 . . . . 72.120000000000005 109.471 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -110.43 128.29 55.52 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.375 -0.602 . . . . 74.239999999999995 109.375 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.44 -70.43 0.59 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.699 -0.852 . . . . 75.209999999999994 108.699 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 55.13 19.24 2.72 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.242 1.017 . . . . 75.129999999999995 112.055 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 73.120000000000005 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.239999999999995 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 65.400000000000006 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.428 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 64.409999999999997 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.541 HG21 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.019999999999996 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.4 ' HA ' ' HB3' ' A' ' 37' ' ' LEU . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 61.0 111.795 178.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.541 ' H ' HG21 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 64.049999999999997 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 72.230000000000004 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 72.219999999999999 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.340000000000003 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' HZ1' ' HB2' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 72.25 111.324 -178.068 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.230000000000004 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.030000000000001 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.46 HD23 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 73.200000000000003 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 72.439999999999998 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.120000000000005 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.507 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.109999999999999 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.140000000000001 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.409999999999997 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 65.219999999999999 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 75.409999999999997 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 72.040000000000006 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.413 ' SG ' ' ND2' ' A' ' 18' ' ' ASN . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.219999999999999 109.964 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 73.230000000000004 110.551 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 74.420000000000002 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 61.420000000000002 111.2 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 74.340000000000003 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.41 ' HB ' HD12 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 75.239999999999995 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.229999999999997 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 74.219999999999999 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.56 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 74.099999999999994 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.492 ' HB2' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.119999999999997 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.639 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 72.340000000000003 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 74.230000000000004 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.458 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.239999999999995 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.329999999999998 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.310000000000002 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.492 ' HA ' ' HB2' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.030000000000001 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.229999999999997 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 75.219999999999999 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.340000000000003 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.442 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.409999999999997 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.049999999999997 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 71.420000000000002 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.41 HD12 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.340000000000003 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.504 HD12 HG21 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 74.150000000000006 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.129999999999995 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.403 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 72.109999999999999 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.329999999999998 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 72.040000000000006 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.129999999999995 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 64.540000000000006 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.75 -103.22 0.21 Allowed Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.019999999999996 111.898 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -129.69 168.6 16.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.627 0.771 . . . . 74.010000000000005 110.932 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -83.34 -14.55 52.64 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.648 0.779 . . . . 75.140000000000001 111.153 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.28 100.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.522 -0.918 . . . . 70.150000000000006 108.522 169.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.17 136.55 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.378 0.671 . . . . 75.129999999999995 110.951 -172.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 74.510000000000005 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.504 HG21 HD12 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 74.400000000000006 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.140000000000001 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . 0.458 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.519999999999996 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.019999999999996 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 74.340000000000003 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.639 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.120000000000005 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.109999999999999 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 63.100000000000001 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 61.210000000000001 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 75.109999999999999 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.409999999999997 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.18 -126.52 23.05 Favored Glycine 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.140000000000001 111.943 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -161.12 168.63 23.95 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.053 0.541 . . . . 73.219999999999999 110.71 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.9 tt -78.57 123.3 26.95 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.179 -1.415 . . . . 52.130000000000003 107.179 171.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.95 -63.73 1.11 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.202 0.601 . . . . 74.310000000000002 110.196 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 124.32 -155.08 18.03 Favored Glycine 0 C--O 1.246 0.854 0 N-CA-C 110.52 -1.032 . . . . 54.43 110.52 -173.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 20.1 t 50.42 59.37 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.329 1.052 . . . . 75.209999999999994 109.156 -174.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-N 114.919 -1.037 . . . . 74.049999999999997 109.696 -174.813 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.513 -0.551 . . . . 72.530000000000001 109.513 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.99 58.26 1.54 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.326 1.06 . . . . 73.120000000000005 111.052 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -101.73 -52.7 3.14 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.471 -0.936 . . . . 73.400000000000006 108.471 168.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.6 t60 57.51 33.85 23.81 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.445 1.098 . . . . 74.310000000000002 112.077 167.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 51.77 66.52 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.407 1.083 . . . . 73.200000000000003 110.926 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -82.04 45.14 0.9 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.051 0.94 . . . . 55.32 110.612 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.51 86.62 1.17 Allowed 'General case' 0 C--O 1.241 0.654 0 C-N-CA 124.533 1.133 . . . . 63.109999999999999 109.277 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -68.59 134.34 49.82 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 114.87 -1.059 . . . . 71.409999999999997 110.016 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -162.95 91.2 0.72 Allowed 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 73.5 107.592 178.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.09 167.8 53.66 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 115.572 -0.74 . . . . 54.219999999999999 112.703 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.38 159.8 32.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.232 1.013 . . . . 73.349999999999994 111.476 -177.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.209999999999994 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.420000000000002 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 63.039999999999999 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 74.25 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.340000000000003 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 75.129999999999995 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.482 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.430000000000007 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m -99.95 111.46 23.76 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.040000000000006 110.743 -174.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 79.0 m -133.75 -68.88 0.55 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.385 1.074 . . . . 75.540000000000006 108.215 171.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -121.21 -50.03 2.15 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.571 0.748 . . . . 74.019999999999996 109.762 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -143.06 115.33 0.91 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 115.705 -0.68 . . . . 71.530000000000001 112.027 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -76.4 110.92 11.33 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.749 0.82 . . . . 74.120000000000005 109.776 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.9 p -104.38 -163.38 0.96 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.687 0.795 . . . . 72.340000000000003 109.408 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -66.38 -24.66 66.52 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.788 -0.57 . . . . 74.349999999999994 109.681 167.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 63.22 -80.54 0.03 OUTLIER 'General case' 0 C--N 1.361 1.091 0 C-N-CA 125.386 1.474 . . . . 73.540000000000006 111.482 175.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.556 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 -153.73 80.86 1.16 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.901 0.88 . . . . 75.340000000000003 108.693 176.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.219999999999999 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 72.120000000000005 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.099999999999994 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.040000000000006 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.530000000000001 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.485 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 72.200000000000003 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.454 ' O ' ' HG3' ' A' ' 38' ' ' GLN . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.310000000000002 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 75.129999999999995 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.53 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.329999999999998 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 75.209999999999994 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.53 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.510000000000005 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.140000000000001 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.479 ' HB3' HG22 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 75.430000000000007 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.340000000000003 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.439999999999998 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.556 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.439999999999998 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HB2' HG11 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 74.150000000000006 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.530000000000001 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 64.239999999999995 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 75.209999999999994 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 74.530000000000001 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.439999999999998 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.400000000000006 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.030000000000001 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.510000000000005 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.415 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.430000000000007 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.415 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 72.209999999999994 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.423 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.519999999999996 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.589 ' HB ' HD22 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 71.129999999999995 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.340000000000003 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 75.150000000000006 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.439999999999998 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 74.340000000000003 110.226 -175.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.575 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.540000000000006 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.230000000000004 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 71.409999999999997 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.310000000000002 111.83 176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.329999999999998 110.511 175.114 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.430000000000007 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.421 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 73.349999999999994 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.209999999999994 111.252 -175.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.438 ' O ' HD11 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 73.439999999999998 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.430000000000007 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.43 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 74.450000000000003 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.589 HD22 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.349999999999994 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.438 HD11 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.519999999999996 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 75.120000000000005 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.479 HG22 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 65.349999999999994 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.510000000000005 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 73.420000000000002 111.017 177.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 71.230000000000004 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.299999999999997 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.69 -121.11 1.06 Allowed Glycine 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.230000000000004 112.079 -172.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.495 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 52.7 m-85 -93.76 155.13 17.4 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.789 0.836 . . . . 74.329999999999998 109.859 -177.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . 0.488 ' HA ' ' HB3' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -61.79 -40.21 94.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.209 0.604 . . . . 70.310000000000002 110.158 -178.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.56 109.56 18.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.138 -0.937 . . . . 71.420000000000002 109.465 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm -125.05 138.9 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 74.530000000000001 107.281 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 74.420000000000002 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.426 ' HA ' HG21 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.340000000000003 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.482 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.310000000000002 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.230000000000004 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.040000000000006 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.575 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.209999999999994 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 71.310000000000002 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.482 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 62.210000000000001 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.482 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 72.450000000000003 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.482 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.319999999999993 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . 0.423 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.5 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 117.19 153.0 9.68 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 54.409999999999997 114.029 168.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -77.07 147.34 36.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.222 1.009 . . . . 74.209999999999994 110.389 178.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 26.0 tp -105.29 136.37 44.95 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.777 -1.194 . . . . 73.450000000000003 107.777 168.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -160.46 155.85 25.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.481 0.312 . . . . 71.129999999999995 110.81 -175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.88 -66.77 3.67 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.456 -0.658 . . . . 73.530000000000001 111.456 -179.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.8 p -119.02 142.39 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 124.023 0.929 . . . . 73.120000000000005 109.197 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.382 1.073 . . . . 75.230000000000004 108.698 176.71 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.729 -0.471 . . . . 71.540000000000006 109.729 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -74.65 118.46 17.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.436 0.694 . . . . 73.310000000000002 110.999 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -139.61 81.38 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 122.126 0.965 . . . . 73.230000000000004 109.313 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -135.79 -11.38 2.04 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 115.345 -0.843 . . . . 72.310000000000002 110.618 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 m80 -114.44 174.42 5.96 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.703 0.801 . . . . 74.450000000000003 109.423 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -84.2 110.24 18.38 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.151 0.58 . . . . 74.129999999999995 109.725 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -128.06 115.7 18.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.111 0.564 . . . . 74.510000000000005 110.741 -175.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.456 ' HG2' ' H ' ' A' ' 9' ' ' SER . 24.7 ttt180 -83.82 177.46 8.33 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 123.611 0.764 . . . . 74.409999999999997 109.127 172.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.456 ' H ' ' HG2' ' A' ' 8' ' ' ARG . 21.2 t 78.01 124.05 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.711 1.604 . . . . 75.329999999999998 109.668 -176.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 9.56 40.31 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.257 -0.883 . . . . 65.540000000000006 110.999 -164.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -73.85 159.77 32.39 Favored 'General case' 0 C--N 1.352 0.716 0 C-N-CA 124.501 1.121 . . . . 72.25 109.441 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.140000000000001 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.439999999999998 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 74.319999999999993 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.513 ' HG2' HG23 ' A' ' 28' ' ' THR . 98.9 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 74.109999999999999 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 25.1 t-20 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.450000000000003 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.430000000000007 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.489 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 71.140000000000001 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p -104.76 131.5 52.14 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.030000000000001 110.883 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.3 t 63.24 40.85 8.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.233 1.413 . . . . 63.439999999999998 111.46 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -86.4 -159.5 0.49 Allowed 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.599 -0.728 . . . . 75.329999999999998 109.351 171.179 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.04 -150.91 4.8 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 112.309 -0.316 . . . . 74.0 112.309 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -85.59 -12.33 51.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.554 0.742 . . . . 74.239999999999995 110.678 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.9 m -60.46 129.47 41.78 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 123.978 0.911 . . . . 72.420000000000002 110.841 176.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -69.73 167.74 16.45 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.482 0.713 . . . . 75.129999999999995 111.642 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.71 135.1 47.48 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.736 1.214 . . . . 64.540000000000006 111.492 177.439 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.495 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 -82.55 87.83 6.67 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.535 0.734 . . . . 73.349999999999994 110.128 -171.098 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.513 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 71.349999999999994 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.539999999999999 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.230000000000004 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.405 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 75.319999999999993 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 60.32 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.483 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 73.0 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.329999999999998 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.491 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.430000000000007 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.483 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 73.450000000000003 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.412 HD12 HD12 ' A' ' 60' ' ' ILE . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 74.530000000000001 111.523 178.335 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.530000000000001 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 75.120000000000005 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.209999999999994 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.310000000000002 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 72.329999999999998 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 74.430000000000007 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.506 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.120000000000005 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.510000000000005 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 71.310000000000002 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.476 HD12 ' HG ' ' A' ' 56' ' ' SER . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 72.510000000000005 109.979 176.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 71.140000000000001 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 74.310000000000002 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.439999999999998 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.430000000000007 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 72.430000000000007 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 73.230000000000004 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 73.340000000000003 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.219999999999999 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.140000000000001 108.634 177.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.412 HD12 HD12 ' A' ' 37' ' ' LEU . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 75.450000000000003 109.474 -179.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 74.040000000000006 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.531 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.299999999999997 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 75.340000000000003 112.531 -168.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 74.409999999999997 110.408 176.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.200000000000003 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 73.099999999999994 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . 0.531 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 74.439999999999998 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 72.219999999999999 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.439999999999998 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.41 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.329999999999998 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.439999999999998 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.475 ' HB1' HG22 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 73.409999999999997 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.405 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 75.430000000000007 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 72.349999999999994 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.484 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 72.549999999999997 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.405 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.239999999999995 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.506 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.319999999999993 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.239999999999995 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.424 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 63.509999999999998 110.587 177.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.200000000000003 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 75.420000000000002 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -144.12 -133.29 2.67 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.349999999999994 111.245 -177.557 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 51.7 m-85 -93.92 166.23 12.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.365 0.666 . . . . 73.010000000000005 109.883 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -58.28 -43.03 87.78 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.457 0.703 . . . . 72.400000000000006 109.958 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.536 ' HB3' HD21 ' A' ' 102' ' ' LEU . 38.1 m-20 -80.26 121.06 25.16 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.78 -1.1 . . . . 70.200000000000003 109.527 176.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm -130.7 151.89 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 124.481 1.113 . . . . 73.049999999999997 109.628 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.129999999999995 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.484 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 74.230000000000004 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 75.120000000000005 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.420000000000002 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.420000000000002 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 64.239999999999995 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.319999999999993 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 75.420000000000002 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . 0.475 HG22 ' HB1' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.009999999999998 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.310000000000002 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 72.120000000000005 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 65.150000000000006 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.47 -151.14 49.3 Favored Glycine 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 74.329999999999998 114.361 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.21 143.54 12.24 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.1 0.56 . . . . 72.310000000000002 110.162 -173.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.536 HD21 ' HB3' ' A' ' 86' ' ' ASP . 1.9 pt? -64.08 110.21 2.09 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.389 0.614 . . . . 72.420000000000002 110.042 174.076 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -94.35 132.58 38.82 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.829 0.852 . . . . 75.239999999999995 110.007 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 165.02 -80.31 0.12 Allowed Glycine 0 C--N 1.339 0.736 0 N-CA-C 110.712 -0.955 . . . . 65.310000000000002 110.712 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.9 m -101.17 153.47 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.671 0.788 . . . . 70.420000000000002 110.515 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 123.831 0.852 . . . . 75.299999999999997 109.099 178.871 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 109.879 -0.415 . . . . 73.319999999999993 109.879 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -147.97 -60.41 0.26 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.035 0.934 . . . . 72.319999999999993 110.14 176.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -85.23 52.55 2.48 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.57 0.748 . . . . 64.450000000000003 111.343 -173.732 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -81.75 130.7 35.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.439 0.696 . . . . 72.140000000000001 109.769 178.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 72.01 13.33 5.93 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.498 1.519 . . . . 75.409999999999997 112.249 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -72.89 -41.82 64.24 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.631 -0.877 . . . . 74.219999999999999 108.631 171.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -169.3 153.29 5.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.061 0.944 . . . . 64.420000000000002 108.883 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -87.93 97.67 11.07 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-O 121.416 0.627 . . . . 75.349999999999994 110.052 177.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 p -107.45 102.06 11.36 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.302 0.641 . . . . 74.219999999999999 109.618 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.13 62.03 0.02 OUTLIER Glycine 0 C--N 1.342 0.884 0 CA-C-N 115.741 -0.663 . . . . 53.210000000000001 111.989 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -69.88 145.99 51.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.140000000000001 110.519 178.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 75.299999999999997 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 38.9 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.510000000000005 108.967 172.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 73.310000000000002 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.209999999999994 109.161 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 73.049999999999997 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.439999999999998 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.462 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.430000000000007 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m -95.4 106.78 18.87 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 74.239999999999995 107.422 168.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 26.4 p -165.0 135.57 3.89 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.896 0.879 . . . . 45.420000000000002 109.212 -170.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.76 113.1 4.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.477 0.711 . . . . 75.25 110.553 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.14 154.13 6.42 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 110.907 -0.877 . . . . 64.129999999999995 110.907 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.54 ' HZ1' ' HB2' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -75.9 -34.87 59.97 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.064 0.546 . . . . 71.420000000000002 110.961 -176.032 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.4 p -97.79 92.93 6.09 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.189 0.596 . . . . 55.329999999999998 111.506 -175.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -137.05 17.19 3.01 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.15 0.98 . . . . 74.129999999999995 109.781 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.33 102.39 15.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.02 1.328 . . . . 74.230000000000004 109.158 -175.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -122.41 79.73 1.65 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.067 0.547 . . . . 74.349999999999994 109.778 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 75.540000000000006 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.450000000000003 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 73.439999999999998 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 75.349999999999994 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.340000000000003 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 75.439999999999998 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 74.439999999999998 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.420000000000002 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.510000000000005 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.459 HD13 HD12 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 74.109999999999999 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 74.019999999999996 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.519999999999996 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 73.319999999999993 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.435 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 75.329999999999998 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 70.329999999999998 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.420000000000002 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 74.519999999999996 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.329999999999998 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 75.540000000000006 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.477 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.319999999999993 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.635 HG22 ' HG ' ' A' ' 53' ' ' CYS . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 73.340000000000003 110.878 -179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.430000000000007 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 73.409999999999997 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.594 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.149999999999999 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 71.109999999999999 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.635 ' HG ' HG22 ' A' ' 48' ' ' ILE . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.019999999999996 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.340000000000003 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 75.420000000000002 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 54.439999999999998 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.420000000000002 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 75.230000000000004 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.415 ' HB3' HG23 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.150000000000006 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.459 HD12 HD13 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.040000000000006 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.209999999999994 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.439999999999998 108.582 171.737 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 74.099999999999994 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.450000000000003 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 74.230000000000004 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.430000000000007 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 74.439999999999998 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 74.230000000000004 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.150000000000006 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.239999999999995 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.435 ' HB3' HG23 ' A' ' 89' ' ' VAL . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.510000000000005 111.051 176.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 54.020000000000003 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.433 ' O ' HG22 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.450000000000003 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.421 ' HB2' HG22 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 72.030000000000001 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.428 HD12 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 74.239999999999995 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 75.510000000000005 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.409999999999997 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 75.010000000000005 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.130000000000003 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.439999999999998 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 72.109999999999999 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.7 -114.67 0.72 Allowed Glycine 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.420000000000002 112.344 -175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -119.72 168.39 11.11 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.984 0.914 . . . . 74.040000000000006 110.757 -175.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -75.81 -8.59 57.23 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.886 0.874 . . . . 74.299999999999997 111.907 -177.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.552 ' HB3' ' HB2' ' A' ' 102' ' ' LEU . 7.7 m-20 -74.28 73.8 1.82 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.715 1.206 . . . . 61.43 110.764 -177.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm -130.12 125.99 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 122.979 0.512 . . . . 75.140000000000001 110.211 -171.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.349999999999994 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.435 HG23 ' HB3' ' A' ' 72' ' ' ALA . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 74.049999999999997 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 72.120000000000005 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 65.349999999999994 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.019999999999996 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.230000000000004 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.230000000000004 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' THR . . . . . 0.415 HG23 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.349999999999994 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 75.239999999999995 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.409999999999997 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.421 HG22 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.540000000000006 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.450000000000003 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 140.64 100.42 0.43 Allowed Glycine 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.129999999999995 112.878 173.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -91.57 113.03 25.19 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 107.55 -1.278 . . . . 73.329999999999998 107.55 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 86' ' ' ASP . 77.7 mt -75.97 116.75 16.98 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.569 0.748 . . . . 74.120000000000005 109.861 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.29 129.14 52.97 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.431 -0.951 . . . . 74.540000000000006 108.431 170.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.39 -127.01 2.72 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.072 -0.811 . . . . 74.219999999999999 111.072 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.92 152.78 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.846 0.858 . . . . 74.299999999999997 110.351 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 123.783 0.833 . . . . 63.200000000000003 109.573 173.103 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.242 0.692 0 CA-C-O 120.933 0.397 . . . . 75.409999999999997 110.766 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 70.340000000000003 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 72.299999999999997 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.019999999999996 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 71.540000000000006 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.329999999999998 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 73.439999999999998 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.430000000000007 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p . . . . . 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 61.009999999999998 109.235 177.891 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.439 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 64.040000000000006 108.561 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.400000000000006 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.209999999999994 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.219999999999999 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.140000000000001 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 62.130000000000003 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.451 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 73.099999999999994 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 71.409999999999997 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.299999999999997 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.451 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.430000000000007 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.310000000000002 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.310000000000002 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.099999999999994 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.129999999999995 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.450000000000003 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.120000000000005 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.129999999999995 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.150000000000006 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 71.230000000000004 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 71.310000000000002 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.239999999999995 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.140000000000001 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 62.340000000000003 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 72.409999999999997 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.219999999999999 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 34.399999999999999 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.219999999999999 109.83 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.310000000000002 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.299999999999997 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.310000000000002 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.438 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 73.209999999999994 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.48 ' HB ' HD21 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.420000000000002 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.219999999999999 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.450000000000003 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.200000000000003 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.461 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.430000000000007 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.209999999999994 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.340000000000003 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.540000000000006 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.319999999999993 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 63.43 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.400000000000006 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.340000000000003 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.329999999999998 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.44 ' HB3' HG21 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.340000000000003 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 54.0 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 78' ' ' VAL . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.310000000000002 110.465 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD21 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 73.109999999999999 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 55.130000000000003 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.409999999999997 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 52.039999999999999 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.310000000000002 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 63.219999999999999 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 45.439999999999998 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.209999999999994 109.256 177.729 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 73.299999999999997 108.984 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . 0.403 ' O ' HG13 ' A' ' 98' ' ' VAL . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 54.210000000000001 110.554 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.239999999999995 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 73.120000000000005 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.400000000000006 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.009999999999998 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 44.329999999999998 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB3' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 52.240000000000002 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 44.409999999999997 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 88' ' ' ASN . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.129999999999995 109.846 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.129999999999995 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 45.229999999999997 114.033 176.52 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 121.114 0.483 . . . . 74.340000000000003 110.609 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.549 HG21 HD22 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 64.310000000000002 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.209999999999994 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.200000000000003 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.549999999999997 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 62.240000000000002 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 52.299999999999997 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 70.230000000000004 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 64.239999999999995 108.257 -175.977 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.510000000000005 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.109999999999999 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 54.32 109.573 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.349999999999994 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.129999999999995 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.329999999999998 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.099999999999994 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.030000000000001 111.634 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.420000000000002 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.522 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 62.119999999999997 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.549 HD22 HG21 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 63.310000000000002 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.209999999999994 111.713 -177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.200000000000003 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 64.019999999999996 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 60' ' ' ILE . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.329999999999998 112.51 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.420000000000002 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 73.230000000000004 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.200000000000003 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.450000000000003 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 55.149999999999999 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.430000000000007 111.061 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 60.310000000000002 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.129999999999995 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 73.219999999999999 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 42.109999999999999 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.010000000000005 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.140000000000001 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.409999999999997 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.450000000000003 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.549999999999997 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 73.099999999999994 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 60.030000000000001 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HD21 ' A' ' 41' ' ' LEU . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 63.549999999999997 109.767 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.140000000000001 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.568 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 55.030000000000001 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.450000000000003 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 62.219999999999999 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.030000000000001 115.113 -168.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.549999999999997 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.329999999999998 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.420000000000002 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.129999999999995 111.389 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 73.120000000000005 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HD2' ' HB2' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.450000000000003 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.239999999999995 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.350000000000001 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.549999999999997 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 71.219999999999999 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 54.539999999999999 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.230000000000004 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 63.310000000000002 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.019999999999996 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.299999999999997 111.602 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 63.100000000000001 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 64.319999999999993 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.329999999999998 113.183 -174.333 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.053 -0.351 . . . . 73.530000000000001 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.209999999999994 110.536 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 71.120000000000005 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.319999999999993 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 73.239999999999995 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 60.439999999999998 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 72.450000000000003 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.140000000000001 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 64.439999999999998 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.230000000000004 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 63.530000000000001 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.43 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.430000000000007 113.428 177.96 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.063 0.458 . . . . 74.430000000000007 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.443 HG21 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 53.340000000000003 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 74.019999999999996 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 72.200000000000003 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.450000000000003 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.695 HD21 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.420000000000002 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.030000000000001 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.200000000000003 108.999 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.530000000000001 109.813 179.062 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.533 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 109.708 -0.478 . . . . 72.430000000000007 109.708 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.239999999999995 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 73.040000000000006 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 53.43 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 63.210000000000001 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.140000000000001 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.617 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.200000000000003 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.219999999999999 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.100000000000001 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.617 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 63.030000000000001 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 64.329999999999998 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.439999999999998 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.140000000000001 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 73.299999999999997 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.120000000000005 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 62.329999999999998 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.439999999999998 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 73.230000000000004 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.441 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 71.030000000000001 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.109999999999999 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 65.400000000000006 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.019999999999996 110.252 -178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 63.240000000000002 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 71.530000000000001 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 63.240000000000002 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 51.219999999999999 111.011 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.439999999999998 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 70.109999999999999 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.439999999999998 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB2' HD21 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.140000000000001 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.420000000000002 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.540000000000006 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.469 ' HB3' HG23 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.209999999999994 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.239999999999995 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.430000000000007 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 73.209999999999994 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 55.049999999999997 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.540000000000006 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.140000000000001 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.420000000000002 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.219999999999999 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.409999999999997 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.450000000000003 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 51.409999999999997 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.493 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.430000000000007 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.200000000000003 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.409999999999997 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 64.439999999999998 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.412 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 72.409999999999997 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 52.149999999999999 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 62.25 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.497 ' HB3' HD12 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.450000000000003 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.239999999999995 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.349999999999994 110.405 171.396 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.450000000000003 111.579 175.245 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.497 HD12 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.233 -0.284 . . . . 74.519999999999996 110.233 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 74.150000000000006 111.212 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.120000000000005 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 63.340000000000003 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.120000000000005 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.230000000000004 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.310000000000002 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.239999999999995 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 61.149999999999999 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.439999999999998 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.469 HG23 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.120000000000005 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 72.420000000000002 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 61.530000000000001 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 70.049999999999997 114.984 168.481 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.337 -0.246 . . . . 75.430000000000007 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.576 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 70.349999999999994 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.129999999999995 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.491 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 29.3 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.430000000000007 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.417 HD21 ' HB2' ' A' ' 56' ' ' SER . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 54.329999999999998 108.56 174.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.340000000000003 108.307 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.450000000000003 110.062 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p . . . . . 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.039999999999999 108.214 172.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.669 -0.205 . . . . 75.109999999999999 111.18 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 63.25 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.209999999999994 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.510000000000005 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 61.43 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.562 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.420000000000002 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 74.409999999999997 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.465 ' H ' HG22 ' A' ' 33' ' ' THR . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.099999999999994 110.147 172.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.562 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 61.130000000000003 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.499 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 71.329999999999998 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 73.400000000000006 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.099999999999994 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.430000000000007 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.488 HD21 HD11 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 71.230000000000004 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.509999999999998 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.239999999999995 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 72.120000000000005 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 62.340000000000003 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 71.140000000000001 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 62.219999999999999 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 61.240000000000002 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.010000000000005 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.120000000000005 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 3.9 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.219999999999999 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 11.24 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.340000000000003 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 51.340000000000003 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' HD21 ' A' ' 16' ' ' ASN . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.230000000000004 109.517 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 52.119999999999997 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.606 ' HB ' HD21 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 55.229999999999997 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.439999999999998 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.499 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.400000000000006 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 72.519999999999996 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.52 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 65.319999999999993 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 73.019999999999996 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.549999999999997 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.439999999999998 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 71.409999999999997 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 62.43 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 70.230000000000004 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 62.509999999999998 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 73.010000000000005 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 72.409999999999997 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.129999999999995 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 71.450000000000003 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 54.229999999999997 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.606 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.530000000000001 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 72.510000000000005 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.230000000000004 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.040000000000006 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 65.299999999999997 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 41.530000000000001 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.430000000000007 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 40.340000000000003 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.409999999999997 109.444 -177.399 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.094 -0.336 . . . . 72.530000000000001 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.420000000000002 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 54.340000000000003 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 72.319999999999993 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.230000000000004 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 53.530000000000001 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.140000000000001 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.209999999999994 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.209999999999994 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 73.510000000000005 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 52.299999999999997 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 51.229999999999997 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.200000000000003 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.200000000000003 112.975 176.964 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 C--O 1.241 0.645 0 N-CA-C 109.969 -0.382 . . . . 74.400000000000006 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 54.520000000000003 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 53.43 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 73.25 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.442 ' HG2' HG23 ' A' ' 28' ' ' THR . 75.9 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.68 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 73.409999999999997 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 71.450000000000003 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.46 HD21 ' N ' ' A' ' 18' ' ' ASN . 0.0 OUTLIER -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.140000000000001 109.902 -179.165 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 33.2 m . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.340000000000003 107.281 163.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.68 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 . . . . . 0 CA--C 1.558 1.271 0 CA-C-O 120.956 0.407 . . . . 74.510000000000005 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.442 HG23 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.340000000000003 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.230000000000004 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 74.019999999999996 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.310000000000002 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 60.43 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.150000000000006 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.430000000000007 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.519999999999996 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 71.230000000000004 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 71.239999999999995 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 65.409999999999997 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.340000000000003 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.129999999999995 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.230000000000004 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.010000000000005 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.349999999999994 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.520000000000003 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.420000000000002 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 72.329999999999998 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 73.230000000000004 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.409999999999997 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.230000000000004 110.594 176.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 54.219999999999999 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.219999999999999 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HD2' ' H ' ' A' ' 19' ' ' THR . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 72.209999999999994 110.002 174.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 64.129999999999995 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 71.239999999999995 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.439999999999998 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 75' ' ' LEU . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.400000000000006 110.385 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 65.140000000000001 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 63.149999999999999 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 52.32 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.420000000000002 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.010000000000005 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 65.349999999999994 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.329999999999998 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.549999999999997 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.57 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.150000000000006 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 71.120000000000005 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.329999999999998 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.474 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.129999999999995 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 44.109999999999999 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.329999999999998 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 64.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.319999999999993 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.120000000000005 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 61.229999999999997 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.209999999999994 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 73.299999999999997 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 64.310000000000002 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.030000000000001 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.239999999999995 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 35.549999999999997 110.797 177.772 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.546 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 70.25 109.562 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.209999999999994 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 72.409999999999997 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.439999999999998 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.400000000000006 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.409999999999997 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.129999999999995 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.672 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.209999999999994 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.43 ' HA ' ' H ' ' A' ' 62' ' ' ALA . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.230000000000004 111.143 -176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 52.530000000000001 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.219999999999999 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 64.129999999999995 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.319999999999993 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 73.340000000000003 111.698 170.071 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 121.135 0.493 . . . . 62.450000000000003 111.987 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.45 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 73.239999999999995 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 60.039999999999999 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 71.430000000000007 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.209999999999994 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.310000000000002 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 61.340000000000003 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.100000000000001 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.47 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p . . . . . 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 63.310000000000002 108.893 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 111.814 0.302 . . . . 63.229999999999997 111.814 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.200000000000003 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 73.510000000000005 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.400000000000006 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.329999999999998 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 35' ' ' SER . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 45.310000000000002 109.638 -178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 70.450000000000003 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.426 ' H ' HG22 ' A' ' 33' ' ' THR . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.299999999999997 111.177 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 60.130000000000003 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.310000000000002 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.540000000000006 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.140000000000001 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.239999999999995 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 63.420000000000002 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 51.219999999999999 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 71.430000000000007 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 63.219999999999999 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 61.109999999999999 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 64.340000000000003 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 55.420000000000002 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 74.400000000000006 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.589 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 74.549999999999997 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 73.109999999999999 111.931 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.140000000000001 112.726 -175.015 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.329999999999998 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.140000000000001 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.47 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 50.310000000000002 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.439999999999998 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 41.219999999999999 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 63.219999999999999 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' HD21 ' A' ' 75' ' ' LEU . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 70.120000000000005 109.312 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 72.200000000000003 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.45 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.329999999999998 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.230000000000004 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 70.120000000000005 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.129999999999995 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 62.140000000000001 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 71.200000000000003 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.349999999999994 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.310000000000002 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.299999999999997 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 72.209999999999994 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.420000000000002 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 42.420000000000002 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 44.420000000000002 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.150000000000006 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD21 ' HB ' ' A' ' 58' ' ' THR . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.340000000000003 111.496 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.539 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.450000000000003 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 72.140000000000001 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.039999999999999 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.340000000000003 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.340000000000003 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.129999999999995 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.589 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 73.120000000000005 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 71.519999999999996 110.638 -178.59 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 109.444 -0.576 . . . . 70.430000000000007 109.444 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.129999999999995 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.539 HG22 HD11 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.140000000000001 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.219999999999999 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.439999999999998 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.040000000000006 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.310000000000002 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.439999999999998 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.230000000000004 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 70.109999999999999 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.200000000000003 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 34.049999999999997 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.140000000000001 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.299999999999997 113.752 172.879 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.604 -0.517 . . . . 70.450000000000003 109.604 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 70.219999999999999 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.450000000000003 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 65.120000000000005 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 60.43 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.54 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 9.2 t30 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.150000000000006 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.239999999999995 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.349999999999994 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 51.399999999999999 108.836 -175.774 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.54 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.884 0.373 . . . . 64.129999999999995 110.141 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.349999999999994 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.109999999999999 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 71.200000000000003 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.230000000000004 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.430000000000007 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.457 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 72.230000000000004 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.239999999999995 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.010000000000005 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.457 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.409999999999997 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 70.040000000000006 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 61.299999999999997 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.310000000000002 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.549999999999997 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HB3' HG21 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.430000000000007 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 60.450000000000003 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.439999999999998 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 60.409999999999997 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' O ' HD21 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 71.209999999999994 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.530000000000001 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.150000000000006 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 71.409999999999997 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.230000000000004 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 55.030000000000001 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.439999999999998 108.403 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.329999999999998 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 42.420000000000002 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 71.239999999999995 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 55.43 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 62.119999999999997 108.186 178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.019999999999996 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.420000000000002 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 61.340000000000003 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.019999999999996 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 73.319999999999993 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 62.310000000000002 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.417 ' HE ' ' HB2' ' A' ' 63' ' ' ARG . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.530000000000001 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 63.420000000000002 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 64.109999999999999 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.140000000000001 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 71.409999999999997 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 64.329999999999998 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 71.400000000000006 112.029 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.099999999999994 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 71.239999999999995 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.140000000000001 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.120000000000005 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.129999999999995 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.420000000000002 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.596 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.510000000000005 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.209999999999994 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.319999999999993 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.120000000000005 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 55.009999999999998 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 71.109999999999999 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.412 HD21 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.530000000000001 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.040000000000006 111.368 -177.627 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.835 -0.431 . . . . 71.319999999999993 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 65.329999999999998 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.596 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.530000000000001 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.129999999999995 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 65.430000000000007 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 62.210000000000001 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 65.5 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.030000000000001 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.099999999999994 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 61.409999999999997 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 72.349999999999994 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.319999999999993 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 52.240000000000002 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.430000000000007 115.871 -179.338 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.219999999999999 110.642 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.230000000000004 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.019999999999996 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.420000000000002 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.109999999999999 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 62.219999999999999 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.299999999999997 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 16.1 m120 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 54.310000000000002 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 52.030000000000001 109.317 -176.695 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 73.200000000000003 110.491 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.150000000000006 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.109999999999999 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 71.329999999999998 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 63.539999999999999 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.230000000000004 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 35' ' ' SER . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.230000000000004 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.340000000000003 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.453 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 54.509999999999998 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.428 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 62.210000000000001 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.209999999999994 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.040000000000006 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 61.229999999999997 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 73.129999999999995 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.310000000000002 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 62.100000000000001 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 65.109999999999999 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 61.229999999999997 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 74.430000000000007 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.409999999999997 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 74.129999999999995 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 62.149999999999999 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.230000000000004 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.509999999999998 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.420000000000002 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.119999999999997 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.439999999999998 108.32 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 71.519999999999996 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 51.219999999999999 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.129999999999995 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 70.129999999999995 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 64.219999999999999 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.319999999999993 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.219999999999999 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.512 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 71.239999999999995 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 71.310000000000002 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.109999999999999 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 63.310000000000002 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.420000000000002 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.409999999999997 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.483 ' HA ' HG21 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.240000000000002 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 61.409999999999997 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.450000000000003 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.310000000000002 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.637 ' HB2' HG11 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.530000000000001 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 64.209999999999994 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 72.420000000000002 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.030000000000001 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 34.240000000000002 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.120000000000005 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 44.109999999999999 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.481 ' HB3' HD12 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.040000000000006 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.019999999999996 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.019999999999996 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.540000000000006 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 43.350000000000001 110.638 -179.202 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.481 HD12 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm . . . . . 0 CA--C 1.548 0.9 0 N-CA-C 110.816 -0.068 . . . . 72.099999999999994 110.816 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.019999999999996 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 61.409999999999997 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 71.319999999999993 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.299999999999997 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.420000000000002 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 71.099999999999994 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.230000000000004 109.989 174.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 50.219999999999999 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.637 HG11 ' HB2' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.049999999999997 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.340000000000003 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 54.109999999999999 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.400000000000006 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 42.229999999999997 112.269 175.855 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 110.393 -0.225 . . . . 71.209999999999994 110.393 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.471 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.040000000000006 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.439999999999998 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 64.319999999999993 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.200000000000003 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.009999999999998 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.329999999999998 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.219999999999999 110.308 -173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m . . . . . 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 64.409999999999997 108.042 172.601 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.1 p90 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.209999999999994 110.223 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.420000000000002 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.329999999999998 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.430000000000007 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 72.25 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 71.019999999999996 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.349999999999994 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 72.430000000000007 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 64.329999999999998 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 73.129999999999995 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 60' ' ' ILE . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.100000000000001 110.771 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 63.299999999999997 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.219999999999999 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.219999999999999 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB3' HG21 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 44.0 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 70.219999999999999 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.219999999999999 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.010000000000005 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.099999999999994 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.230000000000004 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 74.230000000000004 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.319999999999993 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 70.209999999999994 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 71.099999999999994 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.099999999999994 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 21.32 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 63.409999999999997 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.140000000000001 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.120000000000005 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 51.549999999999997 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 73.439999999999998 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' HD21 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 72.510000000000005 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 54.420000000000002 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 37' ' ' LEU . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.310000000000002 109.739 -176.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.219999999999999 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 72.349999999999994 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.239999999999995 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 64.109999999999999 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 72.310000000000002 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 73.200000000000003 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 72.439999999999998 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.510000000000005 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 34.109999999999999 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.099999999999994 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 73.010000000000005 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.319999999999993 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 42.200000000000003 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 70.439999999999998 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.668 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.561 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 63.32 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 61.049999999999997 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.400000000000006 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 72.209999999999994 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 42.329999999999998 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.019999999999996 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.140000000000001 113.28 -175.154 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.402 ' HB ' HG13 ' A' ' 76' ' ' ILE . 48.2 mm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.595 -0.52 . . . . 54.149999999999999 109.595 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.120000000000005 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 51.039999999999999 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 64.409999999999997 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 72.129999999999995 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.120000000000005 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 43.229999999999997 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.54 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.140000000000001 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.540000000000006 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.572 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.120000000000005 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.129999999999995 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.425 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.319999999999993 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.519999999999996 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.430000000000007 112.736 178.073 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 121.532 0.682 . . . . 71.519999999999996 112.025 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.5 HG21 HD22 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 71.040000000000006 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 73.409999999999997 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 53.439999999999998 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 73.030000000000001 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.319999999999993 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 64.439999999999998 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.408 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.319999999999993 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 70.340000000000003 109.546 -177.902 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 72.340000000000003 109.02 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 70.0 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.239999999999995 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 50.109999999999999 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.120000000000005 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.239999999999995 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.340000000000003 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 73.540000000000006 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.120000000000005 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.400000000000006 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.430000000000007 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 54.539999999999999 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.129999999999995 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.319999999999993 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.597 HD21 HD11 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 71.099999999999994 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.230000000000004 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.150000000000006 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.040000000000006 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.519999999999996 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 63.049999999999997 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 63.340000000000003 111.524 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.310000000000002 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 62.0 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.230000000000004 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.120000000000005 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.119999999999997 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.456 ' HB2' HG23 ' A' ' 48' ' ' ILE . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.530000000000001 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 44.240000000000002 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 71.219999999999999 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.400000000000006 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 71.349999999999994 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 70.319999999999993 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.597 HD11 HD21 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 73.319999999999993 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 71.409999999999997 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 64.510000000000005 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 63.109999999999999 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 52.25 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.319999999999993 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.423 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 73.540000000000006 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.129999999999995 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.219999999999999 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 71.230000000000004 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.319999999999993 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.200000000000003 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.099999999999994 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.446 HD13 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.549999999999997 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 61.130000000000003 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 61.420000000000002 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.340000000000003 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 70.420000000000002 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.349999999999994 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 63.030000000000001 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 62.450000000000003 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 54.020000000000003 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.130000000000003 112.049 -179.08 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 100' ' ' GLY . 26.6 mm . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 109.198 -0.668 . . . . 73.239999999999995 109.198 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 63.200000000000003 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 65.530000000000001 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 64.239999999999995 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 72.219999999999999 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.430000000000007 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 40.130000000000003 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.530000000000001 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.430000000000007 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 53.130000000000003 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 72.150000000000006 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.030000000000001 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.420000000000002 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 87' ' ' ILE . . . . . . . . 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 72.299999999999997 113.093 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.223 0.535 . . . . 73.329999999999998 110.525 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.099999999999994 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 61.310000000000002 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 71.540000000000006 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.310000000000002 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 63.240000000000002 109.548 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 71.239999999999995 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.540000000000006 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.239999999999995 110.729 -174.795 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.624 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 121.019 0.438 . . . . 73.420000000000002 110.758 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 61.520000000000003 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.409999999999997 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.310000000000002 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 72.219999999999999 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.200000000000003 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.751 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 61.299999999999997 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 53.119999999999997 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.109999999999999 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.751 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.010000000000005 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.129999999999995 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 64.099999999999994 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 70.239999999999995 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.010000000000005 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 72.329999999999998 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.120000000000005 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.519999999999996 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.099999999999994 110.635 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 64.019999999999996 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.519999999999996 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 72.200000000000003 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.239999999999995 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.099999999999994 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 63.049999999999997 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.624 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 63.119999999999997 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 65.120000000000005 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.150000000000006 108.747 172.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.209999999999994 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.448 ' NH2' ' H ' ' A' ' 100' ' ' GLY . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 65.109999999999999 110.121 -172.128 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.319999999999993 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.409999999999997 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 72.109999999999999 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.349999999999994 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 71.400000000000006 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.532 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 71.040000000000006 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.340000000000003 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.62 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.109999999999999 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 72.400000000000006 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 72.439999999999998 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 52.420000000000002 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 70.530000000000001 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 55.539999999999999 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.129999999999995 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 64.439999999999998 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.230000000000004 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 61.439999999999998 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 63.350000000000001 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.409999999999997 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.677 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 61.240000000000002 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 71.319999999999993 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.467 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.209999999999994 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.510000000000005 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.150000000000006 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.030000000000001 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 51.25 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.340000000000003 111.11 -177.636 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.526 HG21 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.023 -0.732 . . . . 70.310000000000002 109.023 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.530000000000001 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.677 HG22 HD11 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 53.409999999999997 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 64.329999999999998 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.230000000000004 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.319999999999993 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.409999999999997 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.62 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 62.009999999999998 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 74.319999999999993 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 41.329999999999998 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.420000000000002 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 74.329999999999998 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.627 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.448 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . . . . . . 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 32.219999999999999 110.66 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 121.106 0.479 . . . . 65.140000000000001 111.133 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.444 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.210000000000001 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 61.140000000000001 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.519999999999996 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 54.32 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.299999999999997 109.827 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.120000000000005 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.340000000000003 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.8 p . . . . . 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.129999999999995 108.419 171.133 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.814 0.34 . . . . 73.340000000000003 111.703 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.450000000000003 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.413 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.430000000000007 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 55.420000000000002 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.019999999999996 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 73.239999999999995 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.099999999999994 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 71.209999999999994 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.329999999999998 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.049999999999997 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 70.319999999999993 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.540000000000006 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 62.439999999999998 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.120000000000005 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.109999999999999 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.519999999999996 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 64.510000000000005 110.649 -173.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 52.539999999999999 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 55.310000000000002 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.229999999999997 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.420000000000002 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 60.549999999999997 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.049999999999997 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 64.129999999999995 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 72.120000000000005 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.519999999999996 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.209999999999994 108.027 172.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.510000000000005 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 60.32 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.450000000000003 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.4 HG21 HD11 ' A' ' 75' ' ' LEU . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 175.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 53.329999999999998 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 73.209999999999994 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 63.450000000000003 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 65.040000000000006 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 73.150000000000006 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.510000000000005 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.519999999999996 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 62.329999999999998 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.409999999999997 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.230000000000004 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 74.409999999999997 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 61.140000000000001 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.340000000000003 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.340000000000003 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.439999999999998 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 55.039999999999999 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.4 HD11 HG21 ' A' ' 58' ' ' THR . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 72.140000000000001 111.367 -176.118 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.099999999999994 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 64.109999999999999 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 62.039999999999999 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.239999999999995 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 45.439999999999998 110.502 176.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.430000000000007 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 62.130000000000003 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.340000000000003 112.722 -175.672 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.443 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.392 -0.596 . . . . 64.239999999999995 109.392 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 63.229999999999997 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.543 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 64.510000000000005 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 72.239999999999995 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.430000000000007 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 60.299999999999997 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.209999999999994 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.010000000000005 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 51.420000000000002 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 74.530000000000001 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 63.039999999999999 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.329999999999998 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.349999999999994 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 60.200000000000003 113.181 176.088 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.420000000000002 108.232 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.583 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 71.340000000000003 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.129999999999995 108.841 177.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.210000000000001 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 60.130000000000003 108.46 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 65.5 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 53.229999999999997 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.510000000000005 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.450000000000003 110.085 -175.639 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 121.012 0.434 . . . . 64.209999999999994 111.081 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 63.310000000000002 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 61.240000000000002 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.019999999999996 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.489 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.450000000000003 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 62.299999999999997 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.66 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.430000000000007 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.219999999999999 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.209999999999994 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.66 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.340000000000003 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 52.030000000000001 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.129999999999995 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 52.350000000000001 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.109999999999999 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.340000000000003 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.420000000000002 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.150000000000006 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.299999999999997 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 53.450000000000003 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.109999999999999 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.329999999999998 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.404 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 71.329999999999998 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 73.239999999999995 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 60.240000000000002 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 62.340000000000003 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.423 ' H ' HE21 ' A' ' 51' ' ' GLN . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.019999999999996 114.502 172.284 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.403 ' H ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 51.5 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 63.100000000000001 111.684 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 71.439999999999998 108.147 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 71.040000000000006 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.239999999999995 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.5 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.010000000000005 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 43.219999999999999 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 71.439999999999998 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.310000000000002 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 62.310000000000002 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.299999999999997 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 63.43 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 73.340000000000003 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.409999999999997 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.150000000000006 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.329999999999998 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.329999999999998 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.57 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.230000000000004 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.519999999999996 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 78' ' ' VAL . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.420000000000002 110.467 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.409999999999997 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 53.399999999999999 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 60.210000000000001 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 74' ' ' ILE . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 61.020000000000003 110.628 177.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.239999999999995 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.109999999999999 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.239999999999995 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 61.140000000000001 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 72.540000000000006 110.796 178.171 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.431 HG23 HG13 ' A' ' 98' ' ' VAL . 24.0 mm . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.599 0.238 . . . . 62.329999999999998 111.551 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 72.409999999999997 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.477 HG22 HD11 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.219999999999999 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 54.149999999999999 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.310000000000002 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.129999999999995 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 61.119999999999997 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.57 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.310000000000002 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.030000000000001 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 87' ' ' ILE . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.040000000000006 108.06 171.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.109999999999999 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.019999999999996 113.47 175.954 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 121.134 0.492 . . . . 64.519999999999996 109.789 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.319999999999993 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.230000000000004 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 73.150000000000006 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.109999999999999 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.776 HD22 HD11 ' A' ' 44' ' ' LEU . 36.6 m-80 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 54.329999999999998 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 72.140000000000001 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 72.120000000000005 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 54.32 107.483 175.091 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.504 ' HB2' ' ND2' ' A' ' 16' ' ' ASN . 71.3 m-85 . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.010000000000005 108.333 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 54.219999999999999 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.319999999999993 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.530000000000001 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 70.329999999999998 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 72.329999999999998 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.209999999999994 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.483 ' H ' HG22 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 70.409999999999997 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.239999999999995 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 73.439999999999998 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.340000000000003 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 72.120000000000005 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.400000000000006 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 64.340000000000003 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 71.010000000000005 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.040000000000006 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.776 HD11 HD22 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.400000000000006 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.540000000000006 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.340000000000003 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.219999999999999 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.417 ' HA ' HE21 ' A' ' 51' ' ' GLN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.209999999999994 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 64.530000000000001 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 53.109999999999999 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 48' ' ' ILE . 4.7 pp0? -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.030000000000001 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.519999999999996 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.450000000000003 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 72.329999999999998 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.200000000000003 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 60.530000000000001 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 65.530000000000001 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 62.439999999999998 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.299999999999997 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 64.400000000000006 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.230000000000004 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 62.030000000000001 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.662 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.329999999999998 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.430000000000007 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 73.129999999999995 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 64.219999999999999 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 55.299999999999997 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.409999999999997 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.409999999999997 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 73.019999999999996 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 51.109999999999999 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 61.43 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 44.5 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.445 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.450000000000003 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.57 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 64.409999999999997 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.200000000000003 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.239999999999995 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 72.329999999999998 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.299999999999997 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 70.400000000000006 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 73.120000000000005 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.450000000000003 111.165 176.65 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 63.520000000000003 108.024 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 54.140000000000001 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.57 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 62.450000000000003 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.340000000000003 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.310000000000002 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 72.319999999999993 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 33.140000000000001 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 65.450000000000003 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 71.319999999999993 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 63.409999999999997 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 72.299999999999997 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.310000000000002 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.420000000000002 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.299999999999997 112.499 167.421 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 C--O 1.242 0.687 0 CA-C-O 120.887 0.375 . . . . 70.099999999999994 110.799 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 71.409999999999997 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.099999999999994 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 72.340000000000003 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.230000000000004 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.049999999999997 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.400000000000006 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.439999999999998 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 70.519999999999996 108.384 171.954 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.409999999999997 108.423 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.240000000000002 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.150000000000006 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.129999999999995 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.409 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.329999999999998 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 62.100000000000001 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 64.109999999999999 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.420000000000002 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.340000000000003 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.230000000000004 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 63.240000000000002 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.310000000000002 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.510000000000005 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 62.310000000000002 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.010000000000005 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.239999999999995 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.150000000000006 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.520000000000003 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.219999999999999 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.099999999999994 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 64.150000000000006 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.448 HG23 ' SG ' ' A' ' 53' ' ' CYS . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 62.43 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 72.299999999999997 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 71.420000000000002 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 3.9 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.340000000000003 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 61.539999999999999 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.614 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.219999999999999 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 63.210000000000001 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.329999999999998 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 64.209999999999994 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 73.129999999999995 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.239999999999995 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.310000000000002 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 63.109999999999999 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.593 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 63.350000000000001 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.109999999999999 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 72.519999999999996 110.245 -169.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.450000000000003 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.430000000000007 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 61.409999999999997 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 54.409999999999997 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.040000000000006 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.049999999999997 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.540000000000006 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 30.309999999999999 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.349999999999994 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 71.519999999999996 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.530000000000001 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.616 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.120000000000005 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HD2' HG22 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.099999999999994 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.501 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 70.329999999999998 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 65.219999999999999 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 71.209999999999994 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 65.430000000000007 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.230000000000004 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.616 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.44 -0.578 . . . . 72.310000000000002 109.44 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 53.25 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.521 ' HB ' HG22 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 71.409999999999997 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 64.439999999999998 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 43.109999999999999 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.549999999999997 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.400000000000006 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.319999999999993 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.299999999999997 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 52.109999999999999 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.521 HG22 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 54.329999999999998 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.340000000000003 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.430000000000007 113.508 171.454 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 C--O 1.242 0.702 0 N-CA-C 109.905 -0.406 . . . . 73.239999999999995 109.905 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.219999999999999 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.430000000000007 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.400000000000006 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.299999999999997 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.319999999999993 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.310000000000002 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 70.049999999999997 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 62.039999999999999 109.986 177.058 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.36 0.6 . . . . 71.030000000000001 109.45 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.439999999999998 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.409999999999997 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.209999999999994 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 63.409999999999997 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.209999999999994 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.430000000000007 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 62.310000000000002 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 54.219999999999999 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.400000000000006 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD11 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.240000000000002 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 71.430000000000007 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 35' ' ' SER . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.120000000000005 110.879 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.450000000000003 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.409 ' HB3' HG21 ' A' ' 78' ' ' VAL . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 113.309 -170.357 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 55.219999999999999 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 71.349999999999994 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.349999999999994 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 64.400000000000006 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.109999999999999 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 72.150000000000006 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 73.030000000000001 109.359 175.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.120000000000005 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.310000000000002 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 63.530000000000001 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 63.100000000000001 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 61.219999999999999 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 61.310000000000002 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.401 HH22 HD13 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.010000000000005 107.851 172.268 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 53.539999999999999 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.219999999999999 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 64.530000000000001 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.436 HG12 HG22 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 62.409999999999997 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 72.450000000000003 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 52.240000000000002 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.400000000000006 113.368 -169.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.549999999999997 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 62.119999999999997 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.030000000000001 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 63.43 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 62.409999999999997 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.299999999999997 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 60.5 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 64.409999999999997 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 55.020000000000003 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 50.340000000000003 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 33.539999999999999 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.411 HD22 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.239999999999995 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.476 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.230000000000004 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.409999999999997 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 52.100000000000001 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' TYR . . . . . 0.484 ' HB3' HD12 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.219999999999999 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 51.5 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.549999999999997 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 71.129999999999995 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.420000000000002 113.44 -179.218 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.484 HD12 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.299999999999997 107.71 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 62.200000000000003 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.476 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 54.240000000000002 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.200000000000003 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 71.25 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.439999999999998 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.010000000000005 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.230000000000004 110.113 176.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.439999999999998 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 62.25 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.119999999999997 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 73.129999999999995 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.430000000000007 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.020000000000003 113.166 170.819 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.154 0.502 . . . . 73.219999999999999 111.925 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 65.549999999999997 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.100000000000001 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.409999999999997 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.530000000000001 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.508 ' HB2' HD21 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.100000000000001 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 63.439999999999998 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.579 HD21 ' HA ' ' A' ' 56' ' ' SER . 14.1 m120 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.010000000000005 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.530000000000001 108.534 -179.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 112.055 0.391 . . . . 75.129999999999995 112.055 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 72.340000000000003 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.239999999999995 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 53.310000000000002 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.425 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 61.43 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.019999999999996 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 51.219999999999999 111.795 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 55.32 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.464 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 64.450000000000003 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 62.240000000000002 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.340000000000003 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 54.210000000000001 111.324 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.230000000000004 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.030000000000001 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.508 HD21 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 61.32 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 71.430000000000007 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.120000000000005 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.109999999999999 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.140000000000001 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.409999999999997 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 64.349999999999994 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 73.430000000000007 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 62.109999999999999 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.219999999999999 109.964 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 72.349999999999994 110.551 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 71.319999999999993 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.579 ' HA ' HD21 ' A' ' 18' ' ' ASN . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 60.32 111.2 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 64.049999999999997 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.411 ' HB ' HD11 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 41.539999999999999 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.229999999999997 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 72.209999999999994 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 50.100000000000001 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.119999999999997 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.622 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 64.409999999999997 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 72.239999999999995 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.472 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.239999999999995 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.329999999999998 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.310000000000002 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.481 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.030000000000001 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.229999999999997 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 70.140000000000001 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.340000000000003 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.150000000000006 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.049999999999997 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 52.109999999999999 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.411 HD11 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.340000000000003 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.536 HD11 HG22 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 61.039999999999999 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.129999999999995 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.415 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 71.439999999999998 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.329999999999998 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 62.210000000000001 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.129999999999995 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 61.140000000000001 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.019999999999996 111.898 -176.565 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 120.571 0.224 . . . . 75.129999999999995 110.951 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 62.009999999999998 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.536 HG22 HD11 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 61.130000000000003 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.140000000000001 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' TRP . . . . . 0.472 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.519999999999996 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.019999999999996 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 40.130000000000003 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.622 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.120000000000005 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.109999999999999 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 40.25 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 54.030000000000001 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 73.129999999999995 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.25 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.140000000000001 111.943 179.143 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 121.114 0.483 . . . . 63.030000000000001 111.476 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.030000000000001 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.420000000000002 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 54.240000000000002 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 72.200000000000003 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.340000000000003 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 65.540000000000006 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.430000000000007 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m . . . . . 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.040000000000006 110.743 -174.436 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.547 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 108.693 -0.855 . . . . 75.340000000000003 108.693 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.219999999999999 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 70.310000000000002 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.099999999999994 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.040000000000006 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.530000000000001 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.465 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 62.530000000000001 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.453 ' HG3' ' HD3' ' A' ' 70' ' ' LYS . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.099999999999994 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 74.310000000000002 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.329999999999998 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 74.420000000000002 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.510000000000005 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.140000000000001 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.523 ' HB3' HG21 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 64.030000000000001 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.340000000000003 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.439999999999998 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.547 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.439999999999998 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HB2' HG13 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 63.329999999999998 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.530000000000001 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 54.310000000000002 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 74.530000000000001 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 71.0 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.439999999999998 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.400000000000006 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.030000000000001 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.510000000000005 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.427 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.430000000000007 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 63.32 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.431 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.519999999999996 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.61 ' HB ' HD21 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 63.350000000000001 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.340000000000003 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 72.019999999999996 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.439999999999998 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 52.329999999999998 110.226 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.540000000000006 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.230000000000004 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 61.119999999999997 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 70' ' ' LYS . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.310000000000002 111.83 176.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.406 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.329999999999998 110.511 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.420000000000002 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 64.120000000000005 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.4 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.209999999999994 111.252 -175.417 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 61.340000000000003 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.430000000000007 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 73.310000000000002 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.61 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.209999999999994 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.519999999999996 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 64.010000000000005 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.523 HG21 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 63.439999999999998 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.510000000000005 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 30.43 111.017 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 65.230000000000004 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.299999999999997 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.230000000000004 112.079 -172.925 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 70.299999999999997 107.281 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 64.010000000000005 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HA ' HG22 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.340000000000003 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.310000000000002 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.030000000000001 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.040000000000006 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.209999999999994 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 63.43 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 55.509999999999998 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.496 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 71.120000000000005 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.319999999999993 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.409999999999997 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 31.129999999999999 114.029 168.027 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.441 -0.577 . . . . 72.25 109.441 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.140000000000001 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.439999999999998 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 61.420000000000002 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' HG2' HG23 ' A' ' 28' ' ' THR . 28.0 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 62.329999999999998 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 4.1 t30 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.030000000000001 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.430000000000007 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 53.130000000000003 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p . . . . . 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.030000000000001 110.883 -173.579 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.502 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 . . . . . 0 CA--C 1.542 0.659 0 CA-C-O 121.21 0.528 . . . . 73.349999999999994 110.128 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.585 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 52.420000000000002 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.539999999999999 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.230000000000004 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.407 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 74.450000000000003 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 53.200000000000003 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . 0.537 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 71.219999999999999 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.329999999999998 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.430000000000007 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.537 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 72.510000000000005 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 72.549999999999997 111.523 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.530000000000001 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 74.319999999999993 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.209999999999994 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.310000000000002 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 71.209999999999994 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 73.409999999999997 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.51 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.120000000000005 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.510000000000005 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 51.219999999999999 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 62.240000000000002 109.979 176.31 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 65.420000000000002 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 72.340000000000003 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.439999999999998 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.430000000000007 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 62.409999999999997 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 71.019999999999996 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 61.240000000000002 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.150000000000006 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.140000000000001 108.634 177.008 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 73.530000000000001 109.474 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 73.040000000000006 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.299999999999997 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.404 ' HG3' HG23 ' A' ' 64' ' ' THR . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 73.099999999999994 112.531 -168.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 63' ' ' ARG . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 63.310000000000002 110.408 176.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.200000000000003 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 70.549999999999997 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 71.530000000000001 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 71.430000000000007 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.439999999999998 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.329999999999998 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.439999999999998 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 63.240000000000002 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 63.420000000000002 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 35.520000000000003 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.518 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 71.310000000000002 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.239999999999995 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.319999999999993 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.239999999999995 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 33.329999999999998 110.587 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.200000000000003 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 70.140000000000001 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.349999999999994 111.245 -177.557 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.628 -0.508 . . . . 73.049999999999997 109.628 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.129999999999995 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 72.25 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 51.130000000000003 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.420000000000002 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.420000000000002 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 61.109999999999999 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.319999999999993 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 25.440000000000001 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' VAL . . . . . 0.54 HG21 ' HB2' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.009999999999998 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.310000000000002 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 71.450000000000003 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 60.409999999999997 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 72.530000000000001 114.361 170.992 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.140000000000001 110.519 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 72.109999999999999 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.510000000000005 108.967 172.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 64.530000000000001 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.209999999999994 109.161 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 61.409999999999997 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.329999999999998 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.430000000000007 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 73.409999999999997 107.422 168.977 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 109.778 -0.453 . . . . 74.349999999999994 109.778 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 62.149999999999999 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.450000000000003 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 62.020000000000003 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 61.109999999999999 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.340000000000003 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 74.439999999999998 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 73.430000000000007 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.420000000000002 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.510000000000005 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD11 HD13 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 70.5 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 73.420000000000002 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.109999999999999 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 51.329999999999998 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 63.450000000000003 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 54.109999999999999 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.420000000000002 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 64.450000000000003 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.230000000000004 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 74.5 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.319999999999993 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 62.229999999999997 110.878 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.430000000000007 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 64.540000000000006 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.149999999999999 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 62.420000000000002 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 51' ' ' GLN . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.019999999999996 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.340000000000003 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 71.010000000000005 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 42.140000000000001 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.340000000000003 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 72.120000000000005 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG21 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.150000000000006 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.465 HD13 HD11 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.040000000000006 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.209999999999994 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.45 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.439999999999998 108.582 171.737 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 51.43 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.450000000000003 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 63.109999999999999 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.430000000000007 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 33.229999999999997 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 50.039999999999999 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.150000000000006 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.239999999999995 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.510000000000005 111.051 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 42.210000000000001 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.450000000000003 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.444 ' HB2' HG21 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 64.450000000000003 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.452 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 61.149999999999999 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 64.319999999999993 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.409999999999997 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 73.340000000000003 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.130000000000003 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.039999999999999 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 64.010000000000005 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.420000000000002 112.344 -175.675 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.211 -0.292 . . . . 72.420000000000002 110.211 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.349999999999994 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.452 ' HB ' HD11 ' A' ' 76' ' ' ILE . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 60.509999999999998 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 62.140000000000001 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 62.520000000000003 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.019999999999996 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.230000000000004 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.230000000000004 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' THR . . . . . 0.445 HG21 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.349999999999994 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 44.009999999999998 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.409999999999997 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.540000000000006 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.450000000000003 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.129999999999995 112.878 173.495 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.702 -0.481 . . . . 52.130000000000003 109.702 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -121.58 -69.29 0.84 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 108.054 -1.091 . . . . 74.219999999999999 108.054 170.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 56.68 66.58 1.15 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.906 1.282 . . . . 70.519999999999996 111.213 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -65.0 143.46 57.94 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.88 -0.415 . . . . 74.209999999999994 109.88 176.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -67.44 89.17 0.22 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.554 0.692 . . . . 71.329999999999998 110.322 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -99.47 160.11 14.53 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.188 0.995 . . . . 62.049999999999997 110.181 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -93.52 -3.62 52.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.674 -0.694 . . . . 62.5 111.025 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.81 95.78 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.13 0.572 . . . . 62.32 109.871 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -68.55 130.28 42.4 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.873 0.869 . . . . 63.210000000000001 110.908 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.56 -25.26 0.18 Allowed Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.518 -0.633 . . . . 71.439999999999998 111.518 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -79.68 162.72 25.05 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.773 0.829 . . . . 75.409999999999997 110.766 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 70.340000000000003 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 72.299999999999997 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.019999999999996 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 71.540000000000006 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.329999999999998 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 73.439999999999998 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.430000000000007 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p -107.55 111.43 23.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 61.009999999999998 109.235 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.416 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 46.1 m -146.12 -49.85 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.595 1.158 . . . . 64.310000000000002 108.426 -175.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.577 ' HB3' ' HE2' ' A' ' 25' ' ' PHE . 22.8 t-20 -144.3 -39.55 0.28 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 113.986 -1.461 . . . . 74.319999999999993 107.949 173.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 179.03 -171.72 43.81 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 115.048 -0.978 . . . . 71.329999999999998 111.612 172.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -78.96 4.16 15.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.945 0.898 . . . . 74.209999999999994 110.811 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.8 t -61.03 -19.29 61.19 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.685 0.794 . . . . 50.039999999999999 111.216 170.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.577 ' HE2' ' HB3' ' A' ' 21' ' ' ASN . 90.5 m-85 -96.86 22.48 8.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.371 1.068 . . . . 70.129999999999995 111.565 175.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -63.45 146.73 53.01 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 119.362 0.983 . . . . 73.019999999999996 110.83 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.439 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 -123.84 83.01 2.08 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 64.040000000000006 108.561 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.400000000000006 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.209999999999994 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.219999999999999 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.140000000000001 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 62.130000000000003 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.451 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 73.099999999999994 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 71.409999999999997 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.299999999999997 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.451 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.430000000000007 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.310000000000002 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.310000000000002 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.099999999999994 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.129999999999995 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.450000000000003 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.120000000000005 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.129999999999995 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.150000000000006 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 71.230000000000004 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 71.310000000000002 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.239999999999995 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.140000000000001 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 62.340000000000003 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 72.409999999999997 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.219999999999999 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 34.399999999999999 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.219999999999999 109.83 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.310000000000002 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.299999999999997 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.310000000000002 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.438 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 73.209999999999994 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.48 ' HB ' HD21 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.420000000000002 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.219999999999999 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.450000000000003 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.200000000000003 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.461 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.430000000000007 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.209999999999994 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.340000000000003 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.540000000000006 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.319999999999993 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 63.43 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.400000000000006 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.340000000000003 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.329999999999998 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.44 ' HB3' HG21 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.340000000000003 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 54.0 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 78' ' ' VAL . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.310000000000002 110.465 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD21 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 73.109999999999999 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 55.130000000000003 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.409999999999997 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 52.039999999999999 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.310000000000002 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 63.219999999999999 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 45.439999999999998 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.76 106.38 0.29 Allowed Glycine 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.209999999999994 109.256 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -74.75 70.9 1.92 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.113 0.965 . . . . 64.200000000000003 110.237 -174.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -132.79 178.79 6.59 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.209 -1.36 . . . . 74.129999999999995 108.609 -173.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.06 136.23 52.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.321 -0.992 . . . . 74.430000000000007 108.321 163.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm -114.96 143.92 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 73.299999999999997 108.984 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 101' ' ' GLN . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 54.210000000000001 110.554 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.239999999999995 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 73.120000000000005 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.400000000000006 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.009999999999998 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 44.329999999999998 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB3' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 52.240000000000002 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 44.409999999999997 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 88' ' ' ASN . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.129999999999995 109.846 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.129999999999995 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 66.73 -147.65 49.83 Favored Glycine 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 45.229999999999997 114.033 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.736 ' HA ' ' HB2' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -151.03 137.38 18.54 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.662 -0.866 . . . . 73.209999999999994 108.662 175.954 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.22 134.49 48.11 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.535 0.734 . . . . 71.400000000000006 110.13 178.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -136.89 156.87 47.91 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.785 0.834 . . . . 71.049999999999997 110.132 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.34 -95.2 0.17 Allowed Glycine 0 C--N 1.35 1.319 0 O-C-N 123.654 0.596 . . . . 51.210000000000001 112.83 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 39.9 t -69.36 107.03 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.539 0 N-CA-C 108.549 -0.908 . . . . 64.299999999999997 108.549 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 C--O 1.244 0.808 0 N-CA-C 108.96 -0.756 . . . . 74.329999999999998 108.96 -178.756 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.557 ' HB2' ' HB3' ' A' ' 92' ' ' ASP . 1.6 mpt? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.968 -0.382 . . . . 54.240000000000002 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -146.83 85.2 1.62 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.036 0.934 . . . . 63.219999999999999 108.962 173.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -141.68 109.12 5.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.038 0.535 . . . . 65.409999999999997 110.171 -175.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -128.22 135.38 49.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 108.321 -0.992 . . . . 44.32 108.321 176.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -148.76 113.69 5.44 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.632 0.773 . . . . 61.530000000000001 109.231 -174.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -117.85 79.18 1.32 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.806 0.813 . . . . 71.540000000000006 109.068 176.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -86.03 -27.78 24.56 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.123 -0.944 . . . . 74.299999999999997 108.964 166.621 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -130.25 169.85 14.87 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 125.55 1.54 . . . . 74.239999999999995 108.708 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.4 p -67.01 -47.26 72.0 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 108.452 -0.944 . . . . 73.239999999999995 108.452 168.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.65 151.68 4.1 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 114.924 -1.035 . . . . 74.200000000000003 113.58 172.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -74.75 154.17 38.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.415 0.686 . . . . 74.340000000000003 110.609 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.549 HG21 HD22 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 64.310000000000002 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.209999999999994 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.200000000000003 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.549999999999997 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 62.240000000000002 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 52.299999999999997 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 70.230000000000004 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m -108.33 110.58 22.19 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 64.239999999999995 108.257 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -162.65 82.0 0.51 Allowed 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.048 -1.093 . . . . 71.019999999999996 108.048 -172.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -60.32 103.74 0.26 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.9 0.88 . . . . 71.150000000000006 110.095 -175.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 146.88 -51.34 0.58 Allowed Glycine 0 C--O 1.241 0.537 0 CA-C-N 114.804 -1.089 . . . . 72.510000000000005 110.488 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -162.93 127.24 3.0 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.971 0.509 . . . . 71.120000000000005 110.624 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.4 p -132.92 101.6 5.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.604 1.161 . . . . 74.409999999999997 109.033 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -73.18 105.56 4.66 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.819 -0.808 . . . . 65.409999999999997 108.819 171.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -82.29 142.17 32.3 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.791 0.836 . . . . 75.519999999999996 110.422 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -142.77 82.86 1.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.510000000000005 110.292 -173.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.109999999999999 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 54.32 109.573 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.349999999999994 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.129999999999995 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.329999999999998 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.099999999999994 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.030000000000001 111.634 -179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.420000000000002 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.522 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 62.119999999999997 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.549 HD22 HG21 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 63.310000000000002 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 25.5 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.209999999999994 111.713 -177.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.200000000000003 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 64.019999999999996 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 60' ' ' ILE . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.329999999999998 112.51 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.420000000000002 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 73.230000000000004 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.200000000000003 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.450000000000003 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 55.149999999999999 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.430000000000007 111.061 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 60.310000000000002 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.129999999999995 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 73.219999999999999 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 42.109999999999999 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.010000000000005 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.140000000000001 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.409999999999997 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.450000000000003 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.549999999999997 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 73.099999999999994 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 60.030000000000001 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HD21 ' A' ' 41' ' ' LEU . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 63.549999999999997 109.767 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.140000000000001 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.568 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 55.030000000000001 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.507 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.450000000000003 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 62.219999999999999 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.030000000000001 115.113 -168.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.549999999999997 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.329999999999998 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.420000000000002 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.129999999999995 111.389 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 73.120000000000005 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HD2' ' HB2' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.450000000000003 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.239999999999995 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.350000000000001 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.549999999999997 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 71.219999999999999 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 54.539999999999999 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.230000000000004 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 63.310000000000002 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.019999999999996 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.299999999999997 111.602 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 63.100000000000001 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 64.319999999999993 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.01 -79.63 0.05 OUTLIER Glycine 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.329999999999998 113.183 -174.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.416 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 26.3 t80 -160.88 155.17 23.13 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.046 -0.724 . . . . 65.230000000000004 109.046 -170.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.96 -39.03 72.81 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 118.624 0.647 . . . . 74.120000000000005 112.157 -175.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.53 88.29 4.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.372 0.669 . . . . 73.540000000000006 109.769 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm -112.84 148.25 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.007 0.923 . . . . 73.530000000000001 110.053 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.431 ' H ' ' HA ' ' A' ' 101' ' ' GLN . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.209999999999994 110.536 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 71.120000000000005 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.319999999999993 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 73.239999999999995 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 60.439999999999998 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 72.450000000000003 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.140000000000001 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 64.439999999999998 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.230000000000004 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 63.530000000000001 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.43 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 60.8 -113.23 5.36 Favored Glycine 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.430000000000007 113.428 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.431 ' HA ' ' H ' ' A' ' 88' ' ' ASN . 18.7 pt20 -161.41 170.87 19.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.431 1.092 . . . . 53.350000000000001 109.965 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.55 133.22 50.18 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 124.007 0.817 . . . . 75.420000000000002 111.933 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.64 -34.16 46.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.362 0.665 . . . . 75.430000000000007 110.223 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 146.59 -71.05 0.34 Allowed Glycine 0 C--N 1.347 1.169 0 N-CA-C 110.98 -0.848 . . . . 70.450000000000003 110.98 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.6 t 49.94 78.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 125.045 1.338 . . . . 74.510000000000005 111.146 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.051 0.941 . . . . 73.219999999999999 108.549 -177.973 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 109.927 -0.397 . . . . 75.200000000000003 109.927 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 62.39 45.28 6.65 Favored 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 124.546 1.138 . . . . 63.329999999999998 110.909 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -89.11 75.55 7.88 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 122.375 1.083 . . . . 74.519999999999996 109.741 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.1 t-80 -65.49 124.53 22.54 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.534 -1.212 . . . . 65.420000000000002 110.703 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -129.57 155.08 46.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.072 0.949 . . . . 75.409999999999997 110.089 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.83 99.27 2.61 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.671 0.789 . . . . 72.219999999999999 109.793 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -110.9 -28.94 8.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.427 -0.953 . . . . 70.230000000000004 108.427 166.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -117.41 167.83 10.91 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.958 1.303 . . . . 64.310000000000002 109.193 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -86.85 49.49 1.83 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 121.733 0.778 . . . . 54.200000000000003 110.173 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.72 48.8 3.08 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-N 115.372 -0.831 . . . . 73.219999999999999 111.081 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -87.8 129.49 35.17 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.961 0.904 . . . . 74.430000000000007 109.924 -174.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.443 HG21 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 53.340000000000003 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 74.019999999999996 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 72.200000000000003 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.450000000000003 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.695 HD21 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.420000000000002 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.030000000000001 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.532 ' HB3' HD21 ' A' ' 21' ' ' ASN . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.200000000000003 108.999 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m -105.9 137.36 43.92 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.530000000000001 109.813 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 49.8 t 62.41 76.66 0.36 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.716 1.206 . . . . 71.120000000000005 111.065 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.532 HD21 ' HB3' ' A' ' 18' ' ' ASN . 9.6 m120 -113.92 -35.88 4.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.874 -1.057 . . . . 72.120000000000005 109.414 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.35 -69.2 2.57 Favored Glycine 0 C--N 1.354 1.549 0 N-CA-C 110.416 -1.074 . . . . 52.210000000000001 110.416 -171.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -83.83 80.96 8.97 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.513 1.125 . . . . 71.129999999999995 109.558 170.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.2 p -88.22 116.87 26.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.299 -0.864 . . . . 64.120000000000005 110.123 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -106.26 -169.83 1.63 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.69 0.796 . . . . 73.219999999999999 109.814 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.06 107.45 1.53 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.25 0.548 . . . . 73.299999999999997 110.115 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.533 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 -102.44 -4.98 24.61 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.11 -0.95 . . . . 72.430000000000007 109.708 170.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.239999999999995 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 73.040000000000006 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 53.43 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 63.210000000000001 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.140000000000001 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.617 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.200000000000003 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.219999999999999 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.100000000000001 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.617 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 63.030000000000001 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 64.329999999999998 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.439999999999998 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.140000000000001 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 73.299999999999997 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.120000000000005 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 62.329999999999998 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.439999999999998 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 73.230000000000004 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.441 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 71.030000000000001 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.109999999999999 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 65.400000000000006 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.019999999999996 110.252 -178.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 63.240000000000002 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 71.530000000000001 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 63.240000000000002 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' HA2' HD22 ' A' ' 21' ' ' ASN . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 51.219999999999999 111.011 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.439999999999998 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 70.109999999999999 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.439999999999998 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB2' HD21 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.140000000000001 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.420000000000002 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.540000000000006 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.469 ' HB3' HG23 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.209999999999994 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.239999999999995 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.430000000000007 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 73.209999999999994 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 55.049999999999997 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.540000000000006 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.140000000000001 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.420000000000002 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.219999999999999 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.409999999999997 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.450000000000003 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 51.409999999999997 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.493 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.430000000000007 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.200000000000003 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.409999999999997 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 64.439999999999998 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.412 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 72.409999999999997 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 52.149999999999999 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 62.25 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.497 ' HB3' HD12 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.450000000000003 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.239999999999995 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.349999999999994 110.405 171.396 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 169.69 126.5 0.86 Allowed Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.450000000000003 111.579 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -66.07 95.09 0.26 Allowed 'General case' 0 C--N 1.359 0.997 0 CA-C-N 117.794 0.797 . . . . 65.439999999999998 109.429 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -147.51 161.04 41.9 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.511 -0.768 . . . . 74.420000000000002 109.374 -173.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.3 108.95 3.4 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 107.797 -1.186 . . . . 75.420000000000002 107.797 169.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.497 HD12 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm -88.16 133.26 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 122.905 0.482 . . . . 74.519999999999996 110.233 -173.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . 0.483 ' HA ' ' HB2' ' A' ' 102' ' ' LEU . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 74.150000000000006 111.212 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.120000000000005 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 63.340000000000003 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.120000000000005 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.230000000000004 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.310000000000002 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.239999999999995 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 61.149999999999999 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.439999999999998 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.469 HG23 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.120000000000005 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 72.420000000000002 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 61.530000000000001 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.6 -168.74 48.19 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 70.049999999999997 114.984 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -97.74 135.2 39.87 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.011 0.925 . . . . 75.510000000000005 110.999 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 88' ' ' ASN . 45.2 tp -82.72 104.67 13.14 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.037 -1.097 . . . . 64.450000000000003 108.037 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -68.79 150.07 48.26 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 122.886 0.474 . . . . 73.010000000000005 110.233 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -68.9 83.16 0.22 Allowed Glycine 0 C--N 1.349 1.303 0 O-C-N 123.495 0.497 . . . . 75.329999999999998 112.158 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.3 m -73.7 87.71 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 CA-C-O 122.052 0.929 . . . . 62.200000000000003 110.305 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.963 0 CA-C-N 114.786 -1.097 . . . . 74.349999999999994 110.753 -176.029 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 ttp . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.475 -0.194 . . . . 64.010000000000005 110.475 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -133.9 114.67 13.55 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.221 1.008 . . . . 72.0 108.439 172.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -74.11 83.24 1.8 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.123 0.487 . . . . 72.420000000000002 110.49 -178.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -148.83 129.34 13.95 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.297 -1.001 . . . . 65.329999999999998 108.297 173.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.722 ' HB3' ' HB3' ' A' ' 8' ' ' ARG . 82.7 m-70 -85.8 112.69 21.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.263 -0.643 . . . . 74.040000000000006 109.263 -177.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -72.77 90.06 1.39 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.828 0.451 . . . . 64.319999999999993 110.065 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t-80 57.95 30.55 19.33 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.759 1.224 . . . . 53.130000000000003 111.613 174.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.722 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 8.1 tpm_? -92.31 107.73 19.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.689 0.796 . . . . 62.240000000000002 110.045 -176.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.0 t -128.65 176.65 7.62 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.066 0.946 . . . . 71.439999999999998 108.544 172.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.5 22.56 0.74 Allowed Glycine 0 C--N 1.337 0.631 0 N-CA-C 112.1 -0.4 . . . . 63.43 112.1 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -85.29 148.94 25.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.686 0.394 . . . . 75.430000000000007 110.337 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.576 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 70.349999999999994 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.129999999999995 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.491 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 29.3 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.430000000000007 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.417 HD21 ' HB2' ' A' ' 56' ' ' SER . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 54.329999999999998 108.56 174.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.340000000000003 108.307 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.485 ' HB3' ' NE2' ' A' ' 51' ' ' GLN . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.450000000000003 110.062 -176.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p -96.54 110.17 22.61 Favored 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.039999999999999 108.214 172.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.8 t 173.23 149.83 0.07 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.869 1.668 . . . . 71.239999999999995 107.687 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.73 68.9 10.59 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.817 0.818 . . . . 73.239999999999995 109.224 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -155.41 119.32 0.91 Allowed Glycine 0 C--N 1.345 1.04 0 N-CA-C 109.734 -1.346 . . . . 43.350000000000001 109.734 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -73.71 85.74 1.65 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.663 0.744 . . . . 73.5 111.227 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.2 t -122.23 139.18 54.08 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.949 -1.13 . . . . 72.030000000000001 107.949 170.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -62.33 134.94 57.18 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.324 0.65 . . . . 74.030000000000001 111.322 -175.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.17 108.34 6.91 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.124 -1.065 . . . . 73.400000000000006 108.124 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 -58.27 110.36 0.94 Allowed 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.417 1.073 . . . . 75.109999999999999 111.18 -170.588 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 63.25 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.209999999999994 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.510000000000005 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.540000000000006 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 61.43 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.562 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.420000000000002 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 74.409999999999997 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.465 ' H ' HG22 ' A' ' 33' ' ' THR . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.099999999999994 110.147 172.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.562 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 61.130000000000003 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.499 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 71.329999999999998 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 73.400000000000006 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.099999999999994 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.430000000000007 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.488 HD21 HD11 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 71.230000000000004 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.509999999999998 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.239999999999995 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 72.120000000000005 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 62.340000000000003 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 71.140000000000001 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 62.219999999999999 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 61.240000000000002 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.010000000000005 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.120000000000005 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.485 ' NE2' ' HB3' ' A' ' 18' ' ' ASN . 13.7 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.219999999999999 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 11.24 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.340000000000003 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 51.340000000000003 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' HD21 ' A' ' 16' ' ' ASN . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.230000000000004 109.517 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 52.119999999999997 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.606 ' HB ' HD21 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 55.229999999999997 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.439999999999998 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.499 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.400000000000006 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 72.519999999999996 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.52 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 65.319999999999993 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 73.019999999999996 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.549999999999997 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.439999999999998 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 71.409999999999997 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 62.43 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 70.230000000000004 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 62.509999999999998 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 73.010000000000005 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 72.409999999999997 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.129999999999995 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 71.450000000000003 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 54.229999999999997 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.606 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.530000000000001 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 72.510000000000005 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.230000000000004 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.040000000000006 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 65.299999999999997 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 41.530000000000001 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.430000000000007 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 40.340000000000003 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.13 113.73 0.58 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.409999999999997 109.444 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -78.58 74.33 5.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.695 0.798 . . . . 73.420000000000002 110.53 -169.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -147.11 178.33 8.46 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.144 1.377 . . . . 75.200000000000003 108.66 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -75.76 134.53 40.43 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.72 -0.845 . . . . 72.319999999999993 108.72 172.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm -107.01 147.44 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.13 0.572 . . . . 72.530000000000001 110.094 -173.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.420000000000002 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 54.340000000000003 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 72.319999999999993 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.230000000000004 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 53.530000000000001 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.140000000000001 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.209999999999994 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.209999999999994 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 73.510000000000005 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 52.299999999999997 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 51.229999999999997 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.200000000000003 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 76.5 -164.13 53.18 Favored Glycine 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.200000000000003 112.975 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -111.94 155.76 23.19 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.425 0.69 . . . . 71.129999999999995 110.155 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.46 102.55 3.83 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.102 -1.073 . . . . 72.040000000000006 108.102 173.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -85.83 89.9 7.9 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.02 -0.991 . . . . 72.420000000000002 109.0 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 70.06 -106.83 1.94 Allowed Glycine 0 C--N 1.345 1.071 0 CA-C-N 115.514 -0.766 . . . . 45.039999999999999 111.313 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.9 p -143.73 156.7 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.222 1.009 . . . . 62.409999999999997 109.209 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 123.358 0.663 . . . . 61.229999999999997 109.255 173.22 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.351 -0.24 . . . . 64.109999999999999 110.351 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -80.42 -25.39 39.04 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.604 0.362 . . . . 74.329999999999998 110.412 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -74.08 81.49 1.75 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 107.909 -1.145 . . . . 65.530000000000001 107.909 173.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -92.93 106.64 18.57 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.023 -1.103 . . . . 63.450000000000003 108.023 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -61.99 132.39 52.77 Favored 'General case' 0 C--O 1.244 0.775 0 O-C-N 123.458 0.474 . . . . 74.25 110.172 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -86.9 89.03 7.84 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.046 -0.724 . . . . 73.140000000000001 109.046 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -70.32 89.5 0.67 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 108.836 -0.802 . . . . 74.109999999999999 108.836 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.4 ttt-85 -74.19 79.97 1.79 Allowed 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.798 0.808 . . . . 72.430000000000007 109.086 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.4 t -164.84 169.6 16.44 Favored 'General case' 0 C--O 1.252 1.199 0 CA-C-N 114.432 -1.258 . . . . 65.040000000000006 108.353 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.438 ' HA3' ' NE ' ' A' ' 63' ' ' ARG . . . 171.52 60.99 0.04 OUTLIER Glycine 0 CA--C 1.502 -0.728 0 CA-C-N 115.505 -0.77 . . . . 54.299999999999997 111.196 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -63.43 143.78 57.52 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.314 0.646 . . . . 74.400000000000006 109.969 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 54.520000000000003 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 53.43 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 73.25 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.442 ' HG2' HG23 ' A' ' 28' ' ' THR . 75.9 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.68 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 73.409999999999997 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 71.450000000000003 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.46 ' N ' HD21 ' A' ' 18' ' ' ASN . 0.0 OUTLIER -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.140000000000001 109.902 -179.165 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 33.2 m -95.41 110.27 22.33 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.340000000000003 107.281 163.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.561 ' HG ' HG23 ' A' ' 24' ' ' THR . 44.0 t -109.16 112.11 24.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.226 0.61 . . . . 72.510000000000005 109.539 -176.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -75.89 82.2 2.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 72.219999999999999 109.449 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.67 -151.06 10.89 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.405 -0.816 . . . . 74.409999999999997 111.713 -176.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -105.02 -26.27 12.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.088 0.555 . . . . 72.409999999999997 110.523 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.561 HG23 ' HG ' ' A' ' 20' ' ' CYS . 5.2 t -71.29 111.99 7.06 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-O 121.232 0.539 . . . . 63.210000000000001 109.601 175.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -146.07 3.83 0.94 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.62 0.768 . . . . 75.299999999999997 109.455 178.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.71 52.3 1.49 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.549 1.54 . . . . 74.209999999999994 109.916 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.68 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 -80.14 50.86 1.29 Allowed 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.173 0.989 . . . . 74.510000000000005 110.895 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.442 HG23 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.340000000000003 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.230000000000004 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 74.019999999999996 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.310000000000002 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 60.43 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.150000000000006 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.430000000000007 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.519999999999996 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 71.230000000000004 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 71.239999999999995 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 65.409999999999997 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.340000000000003 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.129999999999995 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.230000000000004 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.010000000000005 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.349999999999994 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.520000000000003 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.420000000000002 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 72.329999999999998 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 73.230000000000004 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.409999999999997 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.230000000000004 110.594 176.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 54.219999999999999 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.219999999999999 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HD2' ' H ' ' A' ' 19' ' ' THR . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 72.209999999999994 110.002 174.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 64.129999999999995 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 71.239999999999995 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.439999999999998 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 75' ' ' LEU . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.400000000000006 110.385 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 65.140000000000001 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 63.149999999999999 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 52.32 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.420000000000002 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.010000000000005 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 65.349999999999994 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.329999999999998 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.549999999999997 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.57 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.150000000000006 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 71.120000000000005 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.329999999999998 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.474 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.129999999999995 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 44.109999999999999 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.329999999999998 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 64.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.319999999999993 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.120000000000005 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 61.229999999999997 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.209999999999994 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 73.299999999999997 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 64.310000000000002 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.030000000000001 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.239999999999995 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 161.8 84.08 0.05 OUTLIER Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 35.549999999999997 110.797 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -69.98 98.48 1.29 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.155 0.502 . . . . 75.5 110.562 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -120.51 -67.25 0.99 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 106.873 -1.528 . . . . 73.120000000000005 106.873 169.213 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -153.18 150.53 29.13 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.058 -1.09 . . . . 65.109999999999999 108.058 172.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.546 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm -116.49 110.67 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 70.25 109.562 -174.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.209999999999994 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 72.409999999999997 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.439999999999998 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.400000000000006 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.409999999999997 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.129999999999995 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.672 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.209999999999994 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.43 ' HA ' ' H ' ' A' ' 62' ' ' ALA . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.230000000000004 111.143 -176.179 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 52.530000000000001 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.219999999999999 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 64.129999999999995 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.319999999999993 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -83.16 169.36 47.89 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 73.340000000000003 111.698 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 101' ' ' GLN . 2.6 pm0 -81.84 146.85 29.66 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.669 0.788 . . . . 73.209999999999994 110.181 178.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -76.58 159.6 30.17 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.64 -0.709 . . . . 74.319999999999993 109.497 172.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.87 -25.06 68.11 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.496 0.718 . . . . 63.420000000000002 110.96 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.35 143.89 4.74 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.808 -0.633 . . . . 54.450000000000003 112.782 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 42.9 t -74.38 87.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.723 -0.843 . . . . 63.409999999999997 108.723 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 123.989 0.916 . . . . 72.409999999999997 109.681 -178.609 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ppp? . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 119.76 -0.162 . . . . 63.520000000000003 111.39 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.28 85.3 1.42 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.318 0.647 . . . . 64.150000000000006 110.488 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -158.68 128.58 5.82 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.648 -0.705 . . . . 71.310000000000002 109.975 174.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -141.85 170.38 15.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.734 1.213 . . . . 71.209999999999994 108.711 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -74.38 111.38 9.5 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 109.601 -0.518 . . . . 72.510000000000005 109.601 177.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -79.41 149.97 31.46 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.62 0.768 . . . . 73.109999999999999 110.157 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -86.58 53.53 2.84 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.115 0.966 . . . . 71.409999999999997 108.881 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 55.54 80.57 0.13 Allowed 'General case' 0 C--N 1.359 1.012 0 C-N-CA 124.453 1.101 . . . . 73.299999999999997 109.962 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 m -56.1 116.41 3.0 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.612 0.765 . . . . 74.439999999999998 111.809 -172.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.22 83.57 0.74 Allowed Glycine 0 C--N 1.346 1.089 0 N-CA-C 110.083 -1.207 . . . . 53.119999999999997 110.083 171.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -60.93 129.2 40.26 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.788 . . . . 62.450000000000003 111.987 -172.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.45 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 73.239999999999995 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 60.039999999999999 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 71.430000000000007 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.209999999999994 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.310000000000002 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 61.340000000000003 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.100000000000001 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.47 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p -96.94 117.19 30.6 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 63.310000000000002 108.893 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -160.19 -169.36 2.46 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.313 1.045 . . . . 75.200000000000003 108.642 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -70.61 159.81 33.69 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 109.135 -0.691 . . . . 75.400000000000006 109.135 168.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.66 -149.95 0.28 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 119.921 -0.377 . . . . 51.32 112.249 172.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 65.6 5.5 3.32 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.675 0.79 . . . . 74.150000000000006 111.824 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 39.4 p -132.23 177.73 7.35 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.623 1.169 . . . . 73.5 109.754 -170.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -118.31 164.01 15.84 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.914 0.486 . . . . 74.209999999999994 111.056 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -112.64 160.87 17.45 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.147 -0.933 . . . . 75.5 109.723 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 -102.49 116.92 33.61 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.625 0.37 . . . . 63.229999999999997 111.814 -169.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.200000000000003 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 73.510000000000005 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.400000000000006 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.510000000000005 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.329999999999998 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 35' ' ' SER . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 45.310000000000002 109.638 -178.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 70.450000000000003 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.426 ' H ' HG22 ' A' ' 33' ' ' THR . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.299999999999997 111.177 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 60.130000000000003 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.310000000000002 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.540000000000006 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.140000000000001 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.239999999999995 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 63.420000000000002 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 51.219999999999999 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 71.430000000000007 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 63.219999999999999 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 61.109999999999999 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 64.340000000000003 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 55.420000000000002 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 74.400000000000006 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.589 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 74.549999999999997 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.424 ' HE3' HE21 ' A' ' 51' ' ' GLN . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 73.109999999999999 111.931 -175.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.424 HE21 ' HE3' ' A' ' 50' ' ' LYS . 91.7 mm-40 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.140000000000001 112.726 -175.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.329999999999998 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.140000000000001 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.47 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 50.310000000000002 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.439999999999998 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 41.219999999999999 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 63.219999999999999 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' HD21 ' A' ' 75' ' ' LEU . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 70.120000000000005 109.312 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 74.329999999999998 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 72.200000000000003 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.45 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.329999999999998 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.230000000000004 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 70.120000000000005 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.129999999999995 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 62.140000000000001 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 71.200000000000003 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.349999999999994 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.310000000000002 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.299999999999997 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 72.209999999999994 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.420000000000002 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 42.420000000000002 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 44.420000000000002 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.150000000000006 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD21 ' HB ' ' A' ' 58' ' ' THR . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.340000000000003 111.496 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.539 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.450000000000003 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 72.140000000000001 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.039999999999999 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.340000000000003 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.340000000000003 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.129999999999995 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.589 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 73.120000000000005 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -167.08 89.37 0.1 OUTLIER Glycine 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 71.519999999999996 110.638 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -69.31 85.88 0.4 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.881 0.872 . . . . 72.5 110.233 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -143.39 -168.24 2.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.488 1.515 . . . . 64.519999999999996 108.319 -177.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.18 139.99 48.52 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.096 -0.705 . . . . 65.120000000000005 109.096 169.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm -112.16 125.99 69.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.753 0.821 . . . . 70.430000000000007 109.444 -172.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.129999999999995 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.539 HG22 HD11 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.140000000000001 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.219999999999999 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.439999999999998 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.040000000000006 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.310000000000002 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.439999999999998 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.230000000000004 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 70.109999999999999 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.200000000000003 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 34.049999999999997 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.140000000000001 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.2 -134.19 24.77 Favored Glycine 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.299999999999997 113.752 172.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -146.61 135.13 22.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.425 0.69 . . . . 72.549999999999997 109.589 -172.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -77.87 104.85 8.68 Favored 'General case' 0 C--N 1.35 0.589 0 C-N-CA 122.945 0.498 . . . . 73.019999999999996 109.789 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.43 -26.8 64.79 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.846 -0.615 . . . . 75.150000000000006 110.748 173.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.95 150.94 7.49 Favored Glycine 0 C--N 1.352 1.431 0 CA-C-N 115.919 -0.582 . . . . 64.409999999999997 111.918 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.9 m -89.56 140.6 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.776 0.43 . . . . 74.340000000000003 110.06 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 123.217 0.607 . . . . 71.430000000000007 109.688 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 109.086 -0.709 . . . . 63.039999999999999 109.086 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.6 p80 -114.45 172.32 7.09 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.059 0.944 . . . . 74.420000000000002 109.979 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -140.48 166.21 25.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.6 0.76 . . . . 71.310000000000002 110.189 176.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.64 126.23 27.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.431 1.092 . . . . 63.539999999999999 110.525 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -72.68 95.09 1.82 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.355 0.662 . . . . 53.520000000000003 109.893 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -123.21 -62.86 1.3 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.791 0.837 . . . . 62.310000000000002 109.229 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.9 p80 -99.96 17.73 20.22 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.536 0.734 . . . . 65.140000000000001 109.996 173.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 mtp85 -120.58 119.73 33.74 Favored 'General case' 0 C--N 1.352 0.679 0 C-N-CA 123.723 0.809 . . . . 72.140000000000001 110.561 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 t -162.35 159.7 25.68 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 125.185 1.394 . . . . 55.219999999999999 108.561 174.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.551 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 101.0 -32.7 7.15 Favored Glycine 0 C--N 1.342 0.862 0 CA-C-O 119.809 -0.439 . . . . 51.049999999999997 112.572 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -59.75 127.71 33.31 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.237 0.615 . . . . 70.450000000000003 109.604 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 70.219999999999999 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.450000000000003 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 65.120000000000005 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 60.43 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.54 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 9.2 t30 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.150000000000006 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.239999999999995 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.349999999999994 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p -93.11 111.75 23.48 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 51.399999999999999 108.836 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.7 t -165.69 165.05 18.92 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 125.122 1.369 . . . . 75.219999999999999 108.599 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -89.86 -25.24 21.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.999 0.519 . . . . 63.299999999999997 110.139 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.96 97.75 2.19 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.789 -0.524 . . . . 74.120000000000005 111.789 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -69.35 109.33 4.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.538 0.735 . . . . 70.109999999999999 110.313 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.493 HG21 ' HG3' ' A' ' 51' ' ' GLN . 63.4 p -77.43 -166.12 0.7 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.997 0.919 . . . . 72.540000000000006 109.843 173.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -61.98 -70.5 0.19 Allowed 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.816 -0.438 . . . . 62.530000000000001 109.816 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -177.88 178.21 0.99 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.504 1.122 . . . . 73.230000000000004 109.622 171.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.54 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 -132.24 23.09 4.46 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.089 0.955 . . . . 64.129999999999995 110.141 -177.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.349999999999994 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.109999999999999 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 71.200000000000003 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.230000000000004 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.430000000000007 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.457 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 72.230000000000004 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.239999999999995 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.010000000000005 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.457 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.409999999999997 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 70.040000000000006 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 61.299999999999997 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.310000000000002 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.549999999999997 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HB3' HG21 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.430000000000007 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 60.450000000000003 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.439999999999998 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 60.409999999999997 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' O ' HD21 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 71.209999999999994 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.530000000000001 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.150000000000006 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 71.409999999999997 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.230000000000004 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 55.030000000000001 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' HG3' HG21 ' A' ' 24' ' ' THR . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.439999999999998 108.403 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.329999999999998 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 42.420000000000002 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 71.239999999999995 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 55.43 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 62.119999999999997 108.186 178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.019999999999996 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.420000000000002 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 61.340000000000003 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.019999999999996 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 73.319999999999993 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 62.310000000000002 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.551 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.530000000000001 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 63.420000000000002 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 64.109999999999999 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.140000000000001 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 71.409999999999997 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 64.329999999999998 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 71.400000000000006 112.029 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.099999999999994 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 71.239999999999995 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.140000000000001 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.120000000000005 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.129999999999995 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.420000000000002 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.596 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.510000000000005 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.209999999999994 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.319999999999993 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.120000000000005 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 55.009999999999998 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 71.109999999999999 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.412 HD21 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.530000000000001 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.09 123.64 1.27 Allowed Glycine 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.040000000000006 111.368 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -74.57 2.5 9.59 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.698 0.799 . . . . 72.349999999999994 112.67 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -74.03 162.86 28.58 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.389 0.676 . . . . 74.25 110.19 173.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.99 149.34 32.32 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.366 0.667 . . . . 73.340000000000003 110.963 174.279 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm -105.31 149.45 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.025 0.53 . . . . 71.319999999999993 109.835 -177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 65.329999999999998 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.596 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.530000000000001 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.129999999999995 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 65.430000000000007 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 62.210000000000001 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 65.5 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.030000000000001 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.099999999999994 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 61.409999999999997 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 72.349999999999994 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.319999999999993 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 52.240000000000002 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 21.2 -94.66 0.01 OUTLIER Glycine 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.430000000000007 115.871 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -155.55 158.7 38.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.667 1.187 . . . . 64.450000000000003 109.982 166.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.2 mt -85.51 147.42 26.45 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.507 -0.923 . . . . 73.209999999999994 108.507 167.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.31 -7.81 49.51 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.614 0.766 . . . . 64.019999999999996 112.07 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -160.98 -148.79 5.4 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.865 -0.894 . . . . 74.239999999999995 110.865 171.361 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.1 m -95.1 155.09 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.463 0.705 . . . . 71.299999999999997 109.726 175.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.891 -0.576 . . . . 63.310000000000002 109.983 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.731 -0.47 . . . . 44.119999999999997 109.731 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -124.88 135.61 53.04 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.123 0.969 . . . . 65.120000000000005 109.054 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -65.83 116.4 6.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 123.697 0.623 . . . . 74.230000000000004 109.526 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -66.85 -30.45 70.62 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.438 0.695 . . . . 73.230000000000004 109.452 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.55 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 46.0 p-80 -82.1 88.96 6.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 122.241 1.019 . . . . 75.109999999999999 109.047 174.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -105.43 33.64 3.62 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 108.745 -0.835 . . . . 73.019999999999996 108.745 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 64.44 18.38 11.31 Favored 'General case' 0 CA--C 1.562 1.405 0 C-N-CA 125.292 1.437 . . . . 74.129999999999995 111.272 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -93.55 93.19 7.94 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.188 0.995 . . . . 71.530000000000001 111.132 -177.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.5 t -67.38 148.71 51.26 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.948 0.899 . . . . 64.040000000000006 110.118 170.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 159.3 -109.74 0.41 Allowed Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.586 -0.606 . . . . 64.219999999999999 111.586 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -75.5 116.73 16.53 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.219999999999999 110.642 -175.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.230000000000004 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.019999999999996 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.420000000000002 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.109999999999999 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 62.219999999999999 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.299999999999997 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 16.1 m120 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 54.310000000000002 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -92.51 114.0 26.42 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 52.030000000000001 109.317 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 25.2 p -169.83 -165.27 0.48 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.474 1.11 . . . . 65.019999999999996 108.713 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -63.32 -36.66 84.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 72.549999999999997 110.52 171.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.01 103.03 1.62 Allowed Glycine 0 C--N 1.347 1.187 0 O-C-N 123.432 0.457 . . . . 72.239999999999995 112.357 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -78.36 85.23 4.49 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.096 -1.075 . . . . 71.230000000000004 108.096 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.0 t -81.25 138.3 35.78 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.579 0.704 . . . . 60.100000000000001 111.608 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -138.46 16.52 2.75 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.8 1.64 . . . . 74.209999999999994 107.651 175.189 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -88.73 -36.44 16.14 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.686 -1.143 . . . . 72.519999999999996 111.083 -165.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -79.93 74.13 6.68 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.3 -0.863 . . . . 73.200000000000003 110.491 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.150000000000006 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.109999999999999 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 71.329999999999998 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 63.539999999999999 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.230000000000004 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 35' ' ' SER . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.230000000000004 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.340000000000003 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.453 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 54.509999999999998 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.428 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 62.210000000000001 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.209999999999994 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.040000000000006 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 61.229999999999997 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 73.129999999999995 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.310000000000002 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 62.100000000000001 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 65.109999999999999 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 61.229999999999997 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 74.430000000000007 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.409999999999997 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 74.129999999999995 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 62.149999999999999 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.230000000000004 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 56.7 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.509999999999998 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.420000000000002 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.119999999999997 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.439999999999998 108.32 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 71.519999999999996 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 51.219999999999999 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.129999999999995 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 70.129999999999995 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 64.219999999999999 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.319999999999993 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.219999999999999 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.512 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 71.239999999999995 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 71.310000000000002 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.109999999999999 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 63.310000000000002 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.420000000000002 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.409999999999997 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.483 ' HA ' HG21 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.240000000000002 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 61.409999999999997 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.450000000000003 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.310000000000002 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.637 ' HB2' HG11 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.530000000000001 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 64.209999999999994 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 72.420000000000002 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.030000000000001 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 34.240000000000002 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.120000000000005 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 44.109999999999999 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.481 ' HB3' HD12 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.040000000000006 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.019999999999996 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.019999999999996 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.540000000000006 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.11 110.58 0.31 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 43.350000000000001 110.638 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -74.77 96.54 3.08 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.945 0.498 . . . . 75.140000000000001 110.018 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -163.39 -172.44 2.95 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.002 0.921 . . . . 53.229999999999997 109.068 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.35 108.85 6.45 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.523 -0.547 . . . . 73.519999999999996 109.523 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.481 HD12 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm -86.5 129.43 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.341 0.656 . . . . 72.099999999999994 110.816 -176.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.019999999999996 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 61.409999999999997 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 71.319999999999993 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.299999999999997 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.420000000000002 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 71.099999999999994 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.55 ' HA ' ' HB3' ' A' ' 5' ' ' HIS . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.230000000000004 109.989 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 50.219999999999999 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.637 HG11 ' HB2' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.049999999999997 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.340000000000003 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 54.109999999999999 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.400000000000006 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.54 153.37 45.93 Favored Glycine 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 42.229999999999997 112.269 175.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -73.56 124.67 26.35 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.818 0.447 . . . . 72.25 110.533 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.93 111.18 6.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 106.965 -1.495 . . . . 62.439999999999998 106.965 168.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.77 126.08 26.16 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.776 0.672 . . . . 63.130000000000003 110.942 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.12 -85.1 0.05 OUTLIER Glycine 0 C--N 1.334 0.42 0 N-CA-C 109.334 -1.507 . . . . 72.540000000000006 109.334 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.8 m -122.27 152.81 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.941 0.897 . . . . 63.420000000000002 109.39 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 C--O 1.244 0.808 0 C-N-CA 123.728 0.811 . . . . 63.329999999999998 109.898 -176.151 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtm . . . . . 0 N--CA 1.484 1.225 0 N-CA-C 110.48 -0.193 . . . . 73.420000000000002 110.48 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -148.65 -65.81 0.24 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.111 0.964 . . . . 63.43 108.565 171.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -82.33 102.74 11.42 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 108.95 -0.759 . . . . 73.230000000000004 108.95 175.503 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -80.38 40.43 0.49 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.672 0.789 . . . . 73.150000000000006 112.697 -174.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -168.89 118.5 0.71 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 106.845 -1.539 . . . . 64.030000000000001 106.845 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -76.39 107.56 8.74 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.87 -0.789 . . . . 73.340000000000003 108.87 177.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -77.51 123.43 26.57 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.685 -0.858 . . . . 71.019999999999996 108.685 171.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -65.66 106.59 1.51 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.944 -0.762 . . . . 71.340000000000003 108.944 170.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.2 t -115.04 23.99 12.07 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.017 1.327 . . . . 75.140000000000001 109.929 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.3 51.88 48.78 Favored Glycine 0 C--N 1.351 1.407 0 N-CA-C 110.615 -0.994 . . . . 50.009999999999998 110.615 -169.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -78.35 135.0 37.39 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.452 0.701 . . . . 71.209999999999994 110.393 -170.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.471 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.040000000000006 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.439999999999998 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 64.319999999999993 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.200000000000003 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.009999999999998 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.329999999999998 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.219999999999999 110.308 -173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -95.46 109.88 22.01 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 64.409999999999997 108.042 172.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.4 m 177.45 169.92 0.61 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 127.07 2.148 . . . . 72.439999999999998 107.139 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -131.57 145.49 51.74 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.09 0.556 . . . . 73.450000000000003 109.523 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.0 -107.63 0.83 Allowed Glycine 0 C--N 1.343 0.972 0 O-C-N 123.929 0.768 . . . . 51.140000000000001 111.512 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -88.65 38.68 0.88 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.922 0.889 . . . . 63.299999999999997 111.455 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.1 p -80.07 83.04 6.02 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.815 0.817 . . . . 61.409999999999997 111.231 -178.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -85.97 132.36 34.09 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.653 -1.24 . . . . 61.100000000000001 107.653 167.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.55 86.81 1.6 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 108.454 -0.943 . . . . 75.530000000000001 108.454 174.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -77.33 73.3 3.91 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.209999999999994 110.223 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.420000000000002 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.329999999999998 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.430000000000007 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 72.25 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 71.019999999999996 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.349999999999994 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 72.430000000000007 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 64.329999999999998 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 73.129999999999995 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 60' ' ' ILE . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.100000000000001 110.771 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 63.299999999999997 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.219999999999999 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.219999999999999 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB3' HG21 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 44.0 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 70.219999999999999 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.219999999999999 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.010000000000005 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.099999999999994 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.230000000000004 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 74.230000000000004 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.319999999999993 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 70.209999999999994 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 71.099999999999994 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.099999999999994 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 21.32 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 63.409999999999997 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.140000000000001 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.120000000000005 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 51.549999999999997 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 73.439999999999998 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' HD21 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 72.510000000000005 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 54.420000000000002 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 37' ' ' LEU . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.310000000000002 109.739 -176.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.219999999999999 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 72.349999999999994 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.239999999999995 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 64.109999999999999 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 72.310000000000002 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 73.200000000000003 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 72.439999999999998 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.510000000000005 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 34.109999999999999 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.099999999999994 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 73.010000000000005 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.319999999999993 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 42.200000000000003 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 70.439999999999998 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.668 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.230000000000004 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.561 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 63.32 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 61.049999999999997 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.400000000000006 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 72.209999999999994 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 42.329999999999998 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.019999999999996 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.67 -100.99 0.18 Allowed Glycine 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.140000000000001 113.28 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -132.76 171.85 13.33 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.606 0.763 . . . . 73.200000000000003 111.402 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -83.66 -30.96 26.42 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.989 0.916 . . . . 74.329999999999998 111.104 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.1 90.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.222 -0.659 . . . . 71.209999999999994 109.222 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.495 ' HA ' ' HA ' ' A' ' 101' ' ' GLN . 48.2 mm -122.23 144.02 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.208 0.603 . . . . 54.149999999999999 109.595 -176.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.120000000000005 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 51.039999999999999 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 64.409999999999997 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 72.129999999999995 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.120000000000005 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 43.229999999999997 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.54 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.140000000000001 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.540000000000006 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.572 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.120000000000005 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.129999999999995 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.425 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.319999999999993 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.519999999999996 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.24 -176.95 54.54 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.430000000000007 112.736 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 87' ' ' ILE . 27.6 pt20 -134.38 160.5 37.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.025 0.53 . . . . 71.5 110.626 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.1 mt -95.99 103.45 15.33 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.161 -0.681 . . . . 65.340000000000003 109.161 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.739 0.415 . . . . 64.299999999999997 111.154 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -152.83 -167.04 14.98 Favored Glycine 0 C--N 1.345 1.03 0 N-CA-C 111.345 -0.702 . . . . 51.109999999999999 111.345 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.4 t 59.5 98.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 125.043 1.337 . . . . 72.420000000000002 111.106 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 CA--C 1.547 0.847 0 C-N-CA 123.853 0.861 . . . . 74.150000000000006 109.976 -175.989 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.894 0.378 . . . . 65.409999999999997 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -90.38 99.13 12.21 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.916 0.486 . . . . 75.129999999999995 110.022 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -81.1 71.58 8.09 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.199 -1.037 . . . . 73.019999999999996 108.199 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -83.58 118.45 23.82 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.783 -1.099 . . . . 74.239999999999995 109.453 -174.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -78.67 167.72 20.81 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 123.57 0.748 . . . . 71.150000000000006 110.737 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -73.93 103.96 4.62 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.399 -0.818 . . . . 75.409999999999997 108.793 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.6 p-80 -65.63 -34.62 78.64 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.342 0.402 . . . . 65.540000000000006 110.029 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -75.36 96.1 3.34 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.155 -0.929 . . . . 74.340000000000003 108.751 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.9 m -139.7 174.13 10.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.636 1.174 . . . . 54.240000000000002 108.636 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.4 -24.05 67.19 Favored Glycine 0 CA--C 1.533 1.19 0 O-C-N 123.091 0.244 . . . . 71.140000000000001 113.261 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -76.2 161.08 29.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.107 0.963 . . . . 71.519999999999996 112.025 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.5 HG21 HD22 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 71.040000000000006 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 73.409999999999997 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 53.439999999999998 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 73.030000000000001 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.319999999999993 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 64.439999999999998 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.408 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.319999999999993 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -95.53 111.2 23.15 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 70.340000000000003 109.546 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.53 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 71.4 m -153.61 178.96 9.27 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.077 1.351 . . . . 64.239999999999995 108.68 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -89.63 64.68 6.67 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.444 -0.947 . . . . 72.030000000000001 108.444 172.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -136.6 158.18 23.97 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.081 -0.963 . . . . 61.43 111.362 -177.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -60.62 -60.95 2.99 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.48 0.712 . . . . 71.209999999999994 112.073 -170.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.0 m -153.53 103.22 2.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.67 0.788 . . . . 73.510000000000005 109.279 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -112.95 89.93 3.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.432 0.693 . . . . 74.299999999999997 109.45 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -137.95 152.43 48.95 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.043 -0.725 . . . . 75.420000000000002 109.043 172.233 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -132.19 97.58 4.17 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 72.340000000000003 109.02 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 70.0 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.239999999999995 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 50.109999999999999 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.120000000000005 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.239999999999995 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.340000000000003 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 73.540000000000006 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.120000000000005 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.400000000000006 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.430000000000007 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 54.539999999999999 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.129999999999995 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.319999999999993 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.597 HD21 HD11 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 71.099999999999994 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.230000000000004 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.150000000000006 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.040000000000006 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.519999999999996 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 63.049999999999997 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 63.340000000000003 111.524 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.310000000000002 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 62.0 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.230000000000004 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.120000000000005 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.119999999999997 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.53 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.530000000000001 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.349999999999994 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 44.240000000000002 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 71.219999999999999 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.400000000000006 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 71.349999999999994 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 70.319999999999993 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.597 HD11 HD21 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 73.319999999999993 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 71.409999999999997 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 64.510000000000005 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 63.109999999999999 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 52.25 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.319999999999993 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.423 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 73.540000000000006 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.129999999999995 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.219999999999999 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 71.230000000000004 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.319999999999993 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.200000000000003 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.099999999999994 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.446 HD13 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.549999999999997 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 61.130000000000003 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 61.420000000000002 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.340000000000003 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 70.420000000000002 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.349999999999994 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 63.030000000000001 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 62.450000000000003 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 54.020000000000003 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -140.35 -110.38 0.86 Allowed Glycine 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.130000000000003 112.049 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -138.93 171.08 14.86 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.264 1.026 . . . . 74.310000000000002 110.051 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -75.79 11.49 1.36 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 113.313 0.857 . . . . 74.120000000000005 113.313 -173.354 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 101' ' ' GLN . 5.3 m-20 -85.21 25.23 1.01 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.802 0.841 . . . . 72.019999999999996 111.795 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 100' ' ' GLY . 26.6 mm -83.41 146.86 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.175 0.99 . . . . 73.239999999999995 109.198 -176.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 63.200000000000003 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 65.530000000000001 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 64.239999999999995 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 72.219999999999999 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.430000000000007 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 40.130000000000003 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.530000000000001 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.430000000000007 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 53.130000000000003 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 72.150000000000006 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.030000000000001 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.420000000000002 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 87' ' ' ILE . . . 60.09 -112.83 4.79 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 72.299999999999997 113.093 176.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 86' ' ' ASP . 16.8 pt20 -158.42 170.1 22.97 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 72.099999999999994 109.915 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.4 tp -102.51 110.67 22.69 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.524 -1.287 . . . . 74.430000000000007 107.524 165.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -91.78 111.25 22.7 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.291 1.037 . . . . 75.25 109.236 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.43 68.21 0.58 Allowed Glycine 0 N--CA 1.475 1.264 0 N-CA-C 111.97 -0.452 . . . . 52.329999999999998 111.97 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.4 p -81.55 124.64 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.332 0.653 . . . . 64.209999999999994 110.552 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 123.77 0.828 . . . . 75.319999999999993 109.355 -179.448 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mmm . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 121.237 0.541 . . . . 60.0 109.979 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -132.77 -68.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 106.732 -1.581 . . . . 71.420000000000002 106.732 169.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -88.6 90.19 8.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.098 -1.075 . . . . 54.420000000000002 108.098 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -74.17 147.52 42.51 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.443 -0.577 . . . . 52.149999999999999 109.443 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -68.51 120.1 14.02 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 122.944 0.498 . . . . 70.349999999999994 111.425 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -160.2 108.88 1.7 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.841 0.456 . . . . 53.399999999999999 110.801 -175.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -169.78 55.9 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 107.033 -1.469 . . . . 52.240000000000002 107.033 173.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -171.87 150.32 2.6 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.822 -1.081 . . . . 64.420000000000002 109.971 -172.028 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -79.57 152.23 30.21 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.185 0.594 . . . . 71.109999999999999 110.129 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.01 167.82 29.44 Favored Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.909 -0.476 . . . . 72.349999999999994 111.909 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -77.47 156.34 31.13 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.43 0.692 . . . . 73.329999999999998 110.525 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.099999999999994 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 61.310000000000002 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 71.540000000000006 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.310000000000002 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 31.3 m-80 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 63.240000000000002 109.548 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 71.239999999999995 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.540000000000006 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p -121.23 113.9 20.62 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.239999999999995 110.729 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 53' ' ' CYS . 59.8 m -132.26 158.58 41.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.355 1.462 . . . . 75.549999999999997 108.397 168.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.68 110.32 0.98 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.55 0.74 . . . . 53.119999999999997 111.462 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.13 -99.0 1.77 Allowed Glycine 0 C--N 1.345 1.044 0 CA-C-N 114.828 -1.078 . . . . 62.43 112.207 -178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.05 135.24 34.12 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.696 0.799 . . . . 73.099999999999994 110.765 -174.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.1 m -149.73 143.17 25.26 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.747 0.819 . . . . 54.229999999999997 109.478 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -92.28 115.34 28.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.155 0.503 . . . . 63.409999999999997 110.321 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.59 171.43 9.4 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.053 0.941 . . . . 53.43 109.377 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.624 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 -131.15 142.53 50.24 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.146 0.578 . . . . 73.420000000000002 110.758 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 61.520000000000003 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.409999999999997 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.310000000000002 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 72.219999999999999 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.200000000000003 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.751 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 61.299999999999997 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 53.119999999999997 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.109999999999999 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.751 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.010000000000005 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.129999999999995 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 64.099999999999994 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 70.239999999999995 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.010000000000005 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 72.329999999999998 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.120000000000005 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.519999999999996 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.099999999999994 110.635 -179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 64.019999999999996 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.519999999999996 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 72.200000000000003 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.239999999999995 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.099999999999994 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 63.049999999999997 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.624 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 63.119999999999997 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 65.120000000000005 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.150000000000006 108.747 172.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.209999999999994 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.448 ' NH2' ' H ' ' A' ' 100' ' ' GLY . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 65.109999999999999 110.121 -172.128 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.319999999999993 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.409999999999997 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 72.109999999999999 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.349999999999994 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 71.400000000000006 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.532 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 71.040000000000006 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.340000000000003 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.62 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.109999999999999 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 72.400000000000006 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 72.439999999999998 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 52.420000000000002 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 70.530000000000001 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 55.539999999999999 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.129999999999995 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 64.439999999999998 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.230000000000004 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 61.439999999999998 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 63.350000000000001 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.409999999999997 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.677 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 61.240000000000002 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 71.319999999999993 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.467 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.209999999999994 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.510000000000005 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.150000000000006 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.030000000000001 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 51.25 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.59 99.66 0.17 Allowed Glycine 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.340000000000003 111.11 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -80.66 6.92 11.37 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.33 0.652 . . . . 70.209999999999994 112.2 -176.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -67.42 -84.69 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.732 0.813 . . . . 74.530000000000001 110.725 -178.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.614 ' HB2' ' HB3' ' A' ' 101' ' ' GLN . 15.6 m-20 -151.4 130.83 12.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 71.310000000000002 108.753 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.526 HG21 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm -115.84 133.16 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.554 0.741 . . . . 70.310000000000002 109.023 -178.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.530000000000001 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.677 HG22 HD11 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 53.409999999999997 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 64.329999999999998 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.230000000000004 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.319999999999993 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.409999999999997 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.62 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 62.009999999999998 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 74.319999999999993 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 41.329999999999998 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.420000000000002 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 74.329999999999998 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.627 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.448 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . 128.89 -160.16 22.34 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 32.219999999999999 110.66 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.614 ' HB3' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -131.16 143.69 50.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.418 -1.327 . . . . 70.409999999999997 107.418 175.347 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -66.22 123.92 21.25 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.722 -0.844 . . . . 73.310000000000002 108.722 174.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 75.35 -7.53 1.76 Allowed 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 125.345 1.458 . . . . 74.430000000000007 111.961 -177.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -94.24 72.76 1.13 Allowed Glycine 0 C--N 1.357 1.717 0 C-N-CA 123.207 0.432 . . . . 63.219999999999999 112.318 -176.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 29.2 m -105.57 140.14 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.651 0.78 . . . . 74.530000000000001 109.929 175.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 122.804 0.442 . . . . 71.120000000000005 110.171 -178.064 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.487 -0.56 . . . . 73.439999999999998 109.487 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.68 141.82 32.16 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.023 0.529 . . . . 72.310000000000002 109.574 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -55.54 122.0 10.31 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.285 1.034 . . . . 73.239999999999995 109.615 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -46.51 -43.79 17.14 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.452 1.101 . . . . 70.109999999999999 112.719 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 75.5 t60 61.96 84.29 0.14 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.508 1.13 . . . . 63.439999999999998 110.222 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -73.52 86.46 1.57 Allowed 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.268 0.556 . . . . 74.319999999999993 109.682 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -78.82 131.28 36.43 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.449 -0.796 . . . . 61.329999999999998 109.569 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -81.65 75.23 8.6 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.584 0.754 . . . . 64.230000000000004 109.42 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -168.02 178.55 5.05 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.06 -1.427 . . . . 70.230000000000004 108.696 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.514 ' H ' ' NH2' ' A' ' 63' ' ' ARG . . . 91.98 -38.95 3.09 Favored Glycine 0 N--CA 1.471 1.015 0 N-CA-C 110.991 -0.844 . . . . 64.209999999999994 110.991 -170.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.39 149.75 32.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.224 1.41 . . . . 65.140000000000001 111.133 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.444 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.210000000000001 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 61.140000000000001 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.519999999999996 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 54.32 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.299999999999997 109.827 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.120000000000005 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.340000000000003 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.8 p -98.81 105.82 18.01 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.129999999999995 108.419 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.4 m -167.82 -164.44 0.56 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.662 1.185 . . . . 62.299999999999997 108.918 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -72.58 -33.15 66.56 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.912 0.485 . . . . 60.450000000000003 110.587 170.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.76 62.78 3.26 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.644 -0.582 . . . . 62.520000000000003 111.644 -179.412 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -40.58 89.81 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.089 0.955 . . . . 72.25 110.763 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.9 m -98.15 -88.91 0.31 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.831 -0.803 . . . . 74.140000000000001 108.831 171.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -176.3 167.86 2.82 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.886 0.874 . . . . 72.019999999999996 109.171 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -66.53 99.23 0.56 Allowed 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.349 -0.982 . . . . 74.450000000000003 108.349 166.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 -63.02 108.85 1.31 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.579 1.152 . . . . 73.340000000000003 111.703 -161.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.450000000000003 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.413 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.430000000000007 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 55.420000000000002 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.019999999999996 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 73.239999999999995 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.099999999999994 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 71.209999999999994 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.329999999999998 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.049999999999997 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 70.319999999999993 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.540000000000006 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 62.439999999999998 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.120000000000005 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 26.1 m120 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.109999999999999 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.519999999999996 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 64.510000000000005 110.649 -173.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 52.539999999999999 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 55.310000000000002 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.229999999999997 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.420000000000002 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 60.549999999999997 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.049999999999997 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 64.129999999999995 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 72.120000000000005 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.519999999999996 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.209999999999994 108.027 172.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.510000000000005 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 60.32 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.450000000000003 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.4 HG21 HD11 ' A' ' 75' ' ' LEU . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.230000000000004 109.566 175.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 53.329999999999998 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 73.209999999999994 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 63.450000000000003 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 65.040000000000006 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 73.150000000000006 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.510000000000005 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.519999999999996 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 62.329999999999998 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.409999999999997 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.230000000000004 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 74.409999999999997 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 61.140000000000001 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.340000000000003 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.340000000000003 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.439999999999998 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 55.039999999999999 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.4 HD11 HG21 ' A' ' 58' ' ' THR . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 72.140000000000001 111.367 -176.118 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.099999999999994 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 64.109999999999999 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 62.039999999999999 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.239999999999995 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.505 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 45.439999999999998 110.502 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.430000000000007 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 62.130000000000003 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -161.79 -101.36 0.16 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.340000000000003 112.722 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.505 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 30.8 m-85 -101.65 148.61 25.04 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.957 0.903 . . . . 72.129999999999995 110.161 -170.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -71.26 -27.69 63.62 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 120.852 0.358 . . . . 61.119999999999997 110.587 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.34 114.35 26.12 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.845 -0.798 . . . . 74.310000000000002 108.845 174.372 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.443 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm -129.13 147.98 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.992 . . . . 64.239999999999995 109.392 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 63.229999999999997 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.543 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 64.510000000000005 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 72.239999999999995 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.430000000000007 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 60.299999999999997 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.209999999999994 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.010000000000005 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 51.420000000000002 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 74.530000000000001 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 63.039999999999999 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.329999999999998 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.349999999999994 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.53 -170.11 49.97 Favored Glycine 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 60.200000000000003 113.181 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -118.56 139.87 50.79 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.68 0.792 . . . . 72.120000000000005 109.4 176.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.17 102.07 2.43 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.287 0.635 . . . . 62.229999999999997 109.768 -176.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.43 -48.16 82.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.101 0.561 . . . . 71.510000000000005 109.515 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.33 -158.22 35.47 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-N 115.224 -0.898 . . . . 75.040000000000006 113.878 176.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.2 m -115.85 162.01 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.813 0.845 . . . . 71.230000000000004 109.675 174.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 C--O 1.256 1.404 0 CA-C-O 118.615 -0.707 . . . . 65.420000000000002 109.158 -178.747 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 108.893 -0.78 . . . . 62.149999999999999 108.893 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -88.61 96.25 10.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.365 0.666 . . . . 75.329999999999998 109.486 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -127.5 15.26 7.11 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.696 0.798 . . . . 64.519999999999996 111.517 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -61.87 138.05 58.31 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.299 -0.63 . . . . 75.099999999999994 109.299 175.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -68.74 81.25 0.28 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 123.77 0.669 . . . . 71.219999999999999 109.502 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -78.55 108.79 12.2 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 109.12 -0.696 . . . . 74.299999999999997 109.12 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -119.46 141.55 49.05 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.98 0.912 . . . . 72.209999999999994 109.054 175.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -165.57 -87.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 O-C-N 124.452 1.095 . . . . 71.040000000000006 108.974 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t 164.54 149.16 0.02 OUTLIER 'General case' 0 C--O 1.245 0.823 0 C-N-CA 125.793 1.637 . . . . 54.399999999999999 106.784 -170.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.4 9.32 64.3 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 123.059 0.224 . . . . 73.329999999999998 113.62 -176.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -65.89 134.05 52.2 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.420000000000002 108.232 171.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.583 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 71.340000000000003 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.129999999999995 108.841 177.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.210000000000001 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 60.130000000000003 108.46 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 65.5 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 53.229999999999997 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.510000000000005 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.2 p -125.92 109.27 12.28 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.450000000000003 110.085 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 54' ' ' LYS . 65.6 m -166.56 124.21 1.36 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.099 1.76 . . . . 75.109999999999999 107.337 177.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -62.28 101.62 0.24 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.087 0.555 . . . . 73.040000000000006 110.747 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.19 134.28 7.93 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 115.564 -0.744 . . . . 73.349999999999994 111.259 -175.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.486 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 3.7 ttmp? 66.5 32.22 7.52 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.576 1.15 . . . . 74.219999999999999 110.728 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.3 m -85.9 69.71 10.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.201 -0.909 . . . . 63.020000000000003 109.625 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -87.47 110.42 20.3 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.262 -1.014 . . . . 72.200000000000003 108.262 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.56 56.95 2.49 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 122.05 0.929 . . . . 60.219999999999999 110.867 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -53.94 126.91 24.17 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 114.512 -1.222 . . . . 64.209999999999994 111.081 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 63.310000000000002 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 61.240000000000002 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.019999999999996 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.489 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.450000000000003 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 62.299999999999997 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.66 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.430000000000007 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.219999999999999 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.209999999999994 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.66 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.340000000000003 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 52.030000000000001 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.129999999999995 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 52.350000000000001 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.109999999999999 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.340000000000003 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.420000000000002 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.150000000000006 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.299999999999997 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 53.450000000000003 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.109999999999999 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.329999999999998 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.404 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 71.329999999999998 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 73.239999999999995 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 60.240000000000002 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 1.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 62.340000000000003 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.423 ' H ' HE21 ' A' ' 51' ' ' GLN . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.019999999999996 114.502 172.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.403 ' H ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 51.5 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.432 ' N ' ' SG ' ' A' ' 20' ' ' CYS . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 63.100000000000001 111.684 178.906 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 71.439999999999998 108.147 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 71.040000000000006 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.239999999999995 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.5 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.010000000000005 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 43.219999999999999 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 71.439999999999998 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.310000000000002 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 62.310000000000002 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.299999999999997 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 63.43 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 73.340000000000003 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.409999999999997 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.150000000000006 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.329999999999998 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.329999999999998 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.57 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.230000000000004 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.519999999999996 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 78' ' ' VAL . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.420000000000002 110.467 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.409999999999997 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 53.399999999999999 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 60.210000000000001 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 74' ' ' ILE . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 61.020000000000003 110.628 177.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.239999999999995 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.109999999999999 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.239999999999995 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 61.140000000000001 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 142.31 -143.44 12.8 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 72.540000000000006 110.796 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 41.98 71.24 0.22 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.32 1.448 . . . . 65.230000000000004 113.371 170.359 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -82.13 152.34 26.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.9 -0.591 . . . . 74.400000000000006 109.961 -179.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 62.54 86.56 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.423 1.089 . . . . 75.430000000000007 108.392 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.431 HG23 HG13 ' A' ' 98' ' ' VAL . 24.0 mm -84.14 138.12 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 123.544 0.738 . . . . 62.329999999999998 111.551 -171.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 72.409999999999997 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.477 HG22 HD11 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.219999999999999 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 54.149999999999999 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.310000000000002 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.129999999999995 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.310000000000002 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 61.119999999999997 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.57 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.310000000000002 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.030000000000001 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 87' ' ' ILE . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.040000000000006 108.06 171.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.109999999999999 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 59.9 -128.17 45.82 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.019999999999996 113.47 175.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.1 pp0? -145.83 151.42 37.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.288 0.566 . . . . 74.310000000000002 111.139 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.22 119.84 19.89 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 125.31 1.444 . . . . 75.219999999999999 109.459 177.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.68 88.4 0.7 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 109.152 -0.684 . . . . 60.210000000000001 109.152 172.226 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -153.72 19.18 0.68 Allowed Glycine 0 N--CA 1.468 0.822 0 CA-C-N 114.962 -1.017 . . . . 74.530000000000001 111.972 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.8 t -80.76 92.29 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.548 0 N-CA-C 108.865 -0.791 . . . . 72.5 108.865 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-N 115.19 -0.914 . . . . 64.25 108.714 -179.297 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 110.008 -0.367 . . . . 62.299999999999997 110.008 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -65.99 98.62 0.44 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.15 0.58 . . . . 74.439999999999998 111.119 -175.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -86.57 125.49 33.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.337 0.655 . . . . 73.150000000000006 109.688 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -86.6 -34.25 19.93 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.642 0.734 . . . . 61.439999999999998 110.043 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -126.37 -169.07 1.95 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.013 1.325 . . . . 74.310000000000002 109.373 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -124.95 81.82 2.0 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.016 0.926 . . . . 50.020000000000003 109.186 174.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m170 73.28 -21.91 0.24 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.558 1.543 . . . . 75.140000000000001 112.714 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 102.59 12.9 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.211 1.004 . . . . 74.030000000000001 109.046 -172.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.8 p -156.9 -78.7 0.08 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.418 0.687 . . . . 71.310000000000002 109.923 174.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.409 ' HA2' ' NH2' ' A' ' 63' ' ' ARG . . . -104.62 21.42 36.76 Favored Glycine 0 C--N 1.357 1.718 0 C-N-CA 123.088 0.375 . . . . 62.509999999999998 113.307 -171.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -78.9 121.92 25.46 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.184 0.594 . . . . 64.519999999999996 109.789 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.319999999999993 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.230000000000004 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 73.150000000000006 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.109999999999999 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.776 HD22 HD11 ' A' ' 44' ' ' LEU . 36.6 m-80 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 54.329999999999998 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 72.140000000000001 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 72.120000000000005 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m -106.86 110.81 23.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 54.32 107.483 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.6 t -169.06 161.01 10.28 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.781 0.832 . . . . 63.130000000000003 109.98 -170.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -74.24 139.42 44.33 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.943 0.497 . . . . 72.340000000000003 109.926 174.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.43 -178.53 34.17 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-N 116.117 -0.492 . . . . 72.439999999999998 111.952 -174.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -74.93 97.94 3.46 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.424 0.689 . . . . 32.399999999999999 109.282 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.8 p -65.86 107.77 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.052 0.941 . . . . 62.439999999999998 110.589 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -69.07 109.15 3.86 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 123.601 0.76 . . . . 73.319999999999993 110.625 -179.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.45 151.86 29.07 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.735 0.814 . . . . 75.319999999999993 110.238 175.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.504 ' HB2' ' ND2' ' A' ' 16' ' ' ASN . 71.3 m-85 -127.0 109.54 12.01 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.010000000000005 108.333 174.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 54.219999999999999 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.319999999999993 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.530000000000001 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 70.329999999999998 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 72.329999999999998 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.209999999999994 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.530000000000001 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.483 ' H ' HG22 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 70.409999999999997 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.239999999999995 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 73.439999999999998 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.340000000000003 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 72.120000000000005 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.400000000000006 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 64.340000000000003 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 71.010000000000005 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.040000000000006 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.776 HD11 HD22 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.400000000000006 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.540000000000006 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.340000000000003 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.219999999999999 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.417 ' HA ' HE21 ' A' ' 51' ' ' GLN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.209999999999994 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 64.530000000000001 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 53.109999999999999 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 48' ' ' ILE . 4.7 pp0? -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.030000000000001 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.519999999999996 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.450000000000003 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 72.329999999999998 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.200000000000003 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 60.530000000000001 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 65.530000000000001 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 62.439999999999998 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.299999999999997 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 64.400000000000006 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.230000000000004 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 62.030000000000001 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.662 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.329999999999998 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.430000000000007 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 73.129999999999995 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 64.219999999999999 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 55.299999999999997 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.409999999999997 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.409999999999997 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 73.019999999999996 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 51.109999999999999 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 61.43 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 44.5 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.445 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.450000000000003 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.57 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 64.409999999999997 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.200000000000003 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.239999999999995 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 72.329999999999998 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.299999999999997 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 70.400000000000006 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 73.120000000000005 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -109.97 -143.33 9.81 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.450000000000003 111.165 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -130.15 -59.58 1.04 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.588 0.755 . . . . 73.519999999999996 109.715 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -153.23 150.22 28.77 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.764 -0.653 . . . . 75.109999999999999 110.036 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 33.7 t70 62.1 106.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.815 1.246 . . . . 75.540000000000006 112.415 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.13 135.36 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 63.520000000000003 108.024 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 54.140000000000001 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.57 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 62.450000000000003 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.340000000000003 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.310000000000002 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 72.319999999999993 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 33.140000000000001 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 65.450000000000003 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 71.319999999999993 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 63.409999999999997 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 72.299999999999997 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.310000000000002 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.420000000000002 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -71.18 175.41 39.33 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.299999999999997 112.499 167.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -103.58 156.87 17.45 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.967 0.729 . . . . 74.340000000000003 112.967 -170.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.3 mt -66.09 147.59 53.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.857 1.263 . . . . 72.420000000000002 111.437 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -80.76 80.82 7.16 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 108.243 -1.021 . . . . 72.319999999999993 108.243 168.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -101.49 123.87 8.05 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.416 -0.811 . . . . 70.420000000000002 111.814 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 72.4 t -81.47 87.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.039 -0.726 . . . . 74.239999999999995 109.039 174.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 124.36 1.064 . . . . 55.409999999999997 110.241 179.288 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 111.692 0.256 . . . . 63.229999999999997 111.692 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -74.78 129.64 38.04 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.304 0.642 . . . . 72.129999999999995 110.877 -179.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -77.74 83.6 4.1 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.544 0.688 . . . . 60.100000000000001 109.749 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -78.4 76.28 4.91 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.697 0.76 . . . . 73.420000000000002 109.729 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -147.0 67.3 1.15 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.271 1.028 . . . . 73.530000000000001 108.916 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -156.31 114.47 3.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.681 0.793 . . . . 74.120000000000005 109.883 177.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -90.33 174.1 7.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 123.642 0.777 . . . . 64.329999999999998 110.575 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -75.18 151.05 38.53 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.345 -1.298 . . . . 62.509999999999998 109.444 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.9 m -109.17 153.48 23.7 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 109.366 -0.605 . . . . 52.219999999999999 109.366 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.625 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 89.72 -27.14 8.28 Favored Glycine 0 C--N 1.342 0.892 0 CA-C-N 116.03 -0.532 . . . . 62.32 113.505 176.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -63.93 145.28 56.12 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 123.697 0.799 . . . . 70.099999999999994 110.799 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 71.409999999999997 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.099999999999994 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 72.340000000000003 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.230000000000004 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.049999999999997 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.400000000000006 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.439999999999998 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p -116.27 113.65 23.29 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 70.519999999999996 108.384 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 72.3 m -149.44 -173.89 4.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.246 0.618 . . . . 73.099999999999994 111.163 -172.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -68.24 -24.28 64.89 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.625 0.77 . . . . 73.439999999999998 112.444 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.45 127.65 8.7 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 111.254 -0.738 . . . . 45.100000000000001 111.254 175.31 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -66.16 -25.48 66.98 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 122.971 0.508 . . . . 63.43 111.301 178.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.7 p -85.46 68.07 10.32 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.75 -0.833 . . . . 72.409999999999997 108.75 171.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -94.66 -27.48 15.85 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.107 -0.952 . . . . 74.510000000000005 110.421 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.95 132.63 34.04 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.258 -0.883 . . . . 73.25 109.576 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -132.87 125.85 30.9 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.409999999999997 108.423 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.240000000000002 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.150000000000006 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.129999999999995 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.409 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.329999999999998 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 62.100000000000001 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 64.109999999999999 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.420000000000002 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.340000000000003 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.230000000000004 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 63.240000000000002 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.310000000000002 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.510000000000005 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 62.310000000000002 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.010000000000005 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.239999999999995 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.150000000000006 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.520000000000003 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.219999999999999 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.099999999999994 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 64.150000000000006 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.448 HG23 ' SG ' ' A' ' 53' ' ' CYS . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 62.43 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 72.299999999999997 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 71.420000000000002 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 26.3 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.340000000000003 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 61.539999999999999 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.614 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.219999999999999 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 63.210000000000001 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.329999999999998 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 64.209999999999994 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 73.129999999999995 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.239999999999995 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.310000000000002 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 63.109999999999999 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.593 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 63.350000000000001 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.109999999999999 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.625 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 72.519999999999996 110.245 -169.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.450000000000003 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.430000000000007 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 61.409999999999997 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 54.409999999999997 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.040000000000006 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.049999999999997 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.540000000000006 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 30.309999999999999 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.349999999999994 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 71.519999999999996 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.530000000000001 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.616 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.120000000000005 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HD2' HG22 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.099999999999994 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.501 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 70.329999999999998 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 65.219999999999999 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 71.209999999999994 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 65.430000000000007 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.230000000000004 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -142.16 -87.78 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -170.97 172.49 5.47 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.797 0.839 . . . . 74.329999999999998 109.263 -178.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -59.02 164.29 3.05 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 124.321 1.048 . . . . 54.109999999999999 112.178 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 67.37 86.42 0.13 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.232 1.413 . . . . 75.409999999999997 110.184 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.616 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm -119.13 139.36 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.68 0.792 . . . . 72.310000000000002 109.44 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 53.25 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.521 ' HB ' HG22 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 71.409999999999997 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 64.439999999999998 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.140000000000001 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 43.109999999999999 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.549999999999997 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.400000000000006 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.319999999999993 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.299999999999997 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 52.109999999999999 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.521 HG22 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 54.329999999999998 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.340000000000003 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 81.4 -175.32 54.48 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.430000000000007 113.508 171.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -98.55 152.34 19.67 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.582 0.753 . . . . 71.420000000000002 109.828 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.2 tp -77.69 109.87 12.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.167 0.587 . . . . 74.340000000000003 111.187 -174.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.79 157.86 28.34 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.196 0.998 . . . . 74.310000000000002 110.232 172.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.69 123.93 1.06 Allowed Glycine 0 C--N 1.343 0.948 0 CA-C-O 119.992 -0.338 . . . . 45.530000000000001 112.521 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.49 148.93 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.517 0.727 . . . . 50.340000000000003 110.745 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.248 0.995 0 N-CA-C 108.783 -0.821 . . . . 64.400000000000006 108.783 178.471 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.822 0 CA-C-O 121.561 0.696 . . . . 71.239999999999995 109.753 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -87.86 115.76 25.54 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.555 -0.748 . . . . 63.229999999999997 109.373 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -95.28 57.77 2.03 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.547 0.739 . . . . 65.230000000000004 111.55 -175.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 m80 53.55 28.17 7.48 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.46 1.104 . . . . 63.030000000000001 112.504 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.38 83.23 1.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.694 -0.854 . . . . 75.310000000000002 108.694 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -123.28 111.72 16.77 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.544 1.137 . . . . 74.349999999999994 108.976 -171.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -76.16 99.44 4.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.968 -0.753 . . . . 53.530000000000001 108.968 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -60.28 110.7 1.3 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.33 -0.618 . . . . 74.150000000000006 109.33 176.514 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.1 m -74.93 99.78 3.93 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 115.474 -0.785 . . . . 70.129999999999995 110.6 -176.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.11 -21.96 74.02 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.478 -0.783 . . . . 64.239999999999995 111.538 167.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -67.03 165.17 16.24 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 124.555 1.142 . . . . 73.239999999999995 109.905 166.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.219999999999999 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.430000000000007 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.400000000000006 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.299999999999997 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.319999999999993 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.310000000000002 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 70.049999999999997 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -145.0 125.5 14.02 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 62.039999999999999 109.986 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.2 t -85.05 -63.45 1.33 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 107.661 -1.237 . . . . 72.299999999999997 107.661 173.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -143.07 -51.59 0.36 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.021 1.328 . . . . 71.150000000000006 107.818 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -111.96 -143.28 9.03 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 114.886 -1.052 . . . . 72.049999999999997 110.901 171.579 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -59.57 135.95 57.83 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.765 0.826 . . . . 71.510000000000005 111.338 -177.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.8 m -143.46 151.94 40.93 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.693 0.797 . . . . 72.319999999999993 109.442 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -59.44 118.13 5.65 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.916 0.886 . . . . 64.329999999999998 111.771 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -93.5 158.75 15.55 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.296 1.038 . . . . 55.009999999999998 110.496 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -121.12 86.37 2.56 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.311 0.644 . . . . 71.030000000000001 109.45 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.439999999999998 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.409999999999997 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.209999999999994 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 63.409999999999997 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.209999999999994 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.430000000000007 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 62.310000000000002 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 54.219999999999999 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.400000000000006 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD11 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.240000000000002 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 71.430000000000007 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 35' ' ' SER . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.120000000000005 110.879 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.450000000000003 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.409 ' HB3' HG21 ' A' ' 78' ' ' VAL . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 113.309 -170.357 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 55.219999999999999 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 71.349999999999994 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.349999999999994 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 64.400000000000006 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.109999999999999 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 72.150000000000006 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 73.030000000000001 109.359 175.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.120000000000005 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.310000000000002 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 63.530000000000001 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 63.100000000000001 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 61.219999999999999 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 61.310000000000002 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.401 HH22 HD13 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.010000000000005 107.851 172.268 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 53.539999999999999 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.219999999999999 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 64.530000000000001 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.436 HG12 HG22 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 62.409999999999997 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 72.450000000000003 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 52.240000000000002 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.400000000000006 113.368 -169.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.549999999999997 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 62.119999999999997 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.030000000000001 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 63.43 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 62.409999999999997 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.299999999999997 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 60.5 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 64.409999999999997 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 55.020000000000003 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 50.340000000000003 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 33.539999999999999 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.411 HD22 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.239999999999995 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.476 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.230000000000004 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.409999999999997 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 52.100000000000001 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' TYR . . . . . 0.484 ' HB3' HD12 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.219999999999999 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 51.5 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.549999999999997 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 71.129999999999995 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 51.84 -120.09 9.94 Favored Glycine 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.420000000000002 113.44 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 48.7 t80 67.7 -78.52 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.669 1.588 . . . . 63.229999999999997 111.649 174.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -98.17 171.29 8.32 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.229 0.612 . . . . 74.340000000000003 109.568 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.19 156.25 4.27 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.162 1.385 . . . . 75.109999999999999 112.34 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.484 HD12 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm -113.33 107.51 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.299999999999997 107.71 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 62.200000000000003 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.476 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 54.240000000000002 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.200000000000003 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 71.25 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.439999999999998 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.010000000000005 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.230000000000004 110.113 176.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.439999999999998 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 62.25 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.119999999999997 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 73.129999999999995 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.430000000000007 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.62 -144.03 0.93 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.020000000000003 113.166 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -74.44 108.78 7.42 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.567 -0.531 . . . . 64.430000000000007 109.567 176.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 106' ' ' ASP . 46.5 tp -67.8 126.58 29.87 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.358 -0.979 . . . . 51.310000000000002 108.358 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.68 -52.35 63.64 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.958 0.786 . . . . 65.420000000000002 111.285 -172.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -71.75 -21.85 78.82 Favored Glycine 0 C--N 1.35 1.346 0 CA-C-O 119.564 -0.576 . . . . 60.009999999999998 113.395 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.8 t 63.07 99.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.161 0 C-N-CA 125.171 1.389 . . . . 64.349999999999994 111.453 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.416 ' H ' HD23 ' A' ' 102' ' ' LEU . 36.9 t70 . . . . . 0 C--O 1.251 1.147 0 C-N-CA 123.854 0.862 . . . . 75.109999999999999 109.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 121.035 0.445 . . . . 72.340000000000003 110.171 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.1 p80 177.81 151.03 0.22 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.205 1.402 . . . . 75.340000000000003 109.136 172.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -67.3 94.65 0.39 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.096 -0.705 . . . . 73.420000000000002 109.096 172.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -73.89 110.2 7.99 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.658 -0.868 . . . . 62.530000000000001 108.658 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -91.36 160.36 15.52 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.658 -0.701 . . . . 60.310000000000002 109.67 173.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -72.19 80.42 0.98 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.261 0.553 . . . . 73.439999999999998 110.636 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -163.28 130.32 3.45 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 124.827 1.251 . . . . 55.43 107.765 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -92.81 133.89 35.61 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.217 -0.661 . . . . 75.120000000000005 109.217 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 t -100.0 27.24 5.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.937 0.895 . . . . 71.209999999999994 110.054 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.73 50.03 60.78 Favored Glycine 0 C--N 1.35 1.348 0 N-CA-C 110.081 -1.208 . . . . 73.439999999999998 110.081 -169.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -73.22 159.12 33.94 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.938 0.895 . . . . 73.219999999999999 111.925 -166.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 65.549999999999997 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.100000000000001 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.409999999999997 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.530000000000001 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.508 ' HB2' HD21 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.100000000000001 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 63.439999999999998 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.579 HD21 ' HA ' ' A' ' 56' ' ' SER . 14.1 m120 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.010000000000005 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m -92.5 109.14 20.53 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.530000000000001 108.534 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 54' ' ' LYS . 26.3 p -168.28 165.57 12.92 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.184 1.394 . . . . 71.510000000000005 108.486 179.027 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.51 98.9 1.18 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 108.926 -0.768 . . . . 64.230000000000004 108.926 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -139.9 158.5 25.73 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.7 -0.682 . . . . 54.140000000000001 112.011 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -83.19 -76.97 0.26 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 122.981 0.513 . . . . 54.409999999999997 110.05 -172.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.8 p -144.06 97.51 3.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.366 1.066 . . . . 71.129999999999995 109.471 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -110.43 128.29 55.52 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.375 -0.602 . . . . 74.239999999999995 109.375 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.44 -70.43 0.59 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.699 -0.852 . . . . 75.099999999999994 108.699 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 55.13 19.24 2.72 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.242 1.017 . . . . 75.129999999999995 112.055 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 72.340000000000003 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.239999999999995 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 53.310000000000002 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.425 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 61.43 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.019999999999996 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 51.219999999999999 111.795 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 55.32 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.464 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 64.450000000000003 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 62.240000000000002 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.340000000000003 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 54.210000000000001 111.324 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.230000000000004 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.030000000000001 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.508 HD21 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 61.32 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 71.430000000000007 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.120000000000005 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.109999999999999 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.140000000000001 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.409999999999997 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 64.349999999999994 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 73.430000000000007 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 62.109999999999999 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.219999999999999 109.964 179.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.454 ' H ' ' HB3' ' A' ' 20' ' ' CYS . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 72.349999999999994 110.551 -178.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 71.319999999999993 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.579 ' HA ' HD21 ' A' ' 18' ' ' ASN . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 60.32 111.2 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 64.049999999999997 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.411 ' HB ' HD11 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 41.539999999999999 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.229999999999997 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 72.209999999999994 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 50.100000000000001 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.119999999999997 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.622 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 64.409999999999997 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 72.239999999999995 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.472 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.239999999999995 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.329999999999998 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.310000000000002 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.481 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.030000000000001 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.229999999999997 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 70.140000000000001 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.340000000000003 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.150000000000006 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.049999999999997 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 52.109999999999999 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.411 HD11 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.340000000000003 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD11 HG22 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 61.039999999999999 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.129999999999995 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.415 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 71.439999999999998 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.329999999999998 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 62.210000000000001 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.129999999999995 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 61.140000000000001 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.75 -103.22 0.21 Allowed Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.019999999999996 111.898 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -129.69 168.6 16.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.627 0.771 . . . . 74.010000000000005 110.932 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -83.34 -14.55 52.64 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.648 0.779 . . . . 70.310000000000002 111.153 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.28 100.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.522 -0.918 . . . . 62.119999999999997 108.522 169.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.17 136.55 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.378 0.671 . . . . 75.129999999999995 110.951 -172.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 62.009999999999998 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.536 HG22 HD11 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 61.130000000000003 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.140000000000001 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' TRP . . . . . 0.472 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.519999999999996 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.019999999999996 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 40.130000000000003 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.622 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.120000000000005 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.109999999999999 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 40.25 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 54.030000000000001 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 73.129999999999995 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.25 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.18 -126.52 23.05 Favored Glycine 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.140000000000001 111.943 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -161.12 168.63 23.95 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.053 0.541 . . . . 72.420000000000002 110.71 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.9 tt -78.57 123.3 26.95 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.179 -1.415 . . . . 52.130000000000003 107.179 171.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.95 -63.73 1.11 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.202 0.601 . . . . 74.310000000000002 110.196 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 124.32 -155.08 18.03 Favored Glycine 0 C--O 1.246 0.854 0 N-CA-C 110.52 -1.032 . . . . 42.0 110.52 -173.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 20.1 t 50.42 59.37 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.329 1.052 . . . . 75.209999999999994 109.156 -174.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-N 114.919 -1.037 . . . . 74.049999999999997 109.696 -174.813 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.513 -0.551 . . . . 72.530000000000001 109.513 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.99 58.26 1.54 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.326 1.06 . . . . 73.120000000000005 111.052 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -101.73 -52.7 3.14 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.471 -0.936 . . . . 71.129999999999995 108.471 168.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.6 t60 57.51 33.85 23.81 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.445 1.098 . . . . 74.310000000000002 112.077 167.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 51.77 66.52 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.407 1.083 . . . . 73.200000000000003 110.926 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -82.04 45.14 0.9 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.051 0.94 . . . . 54.43 110.612 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.51 86.62 1.17 Allowed 'General case' 0 C--O 1.241 0.654 0 C-N-CA 124.533 1.133 . . . . 61.140000000000001 109.277 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -68.59 134.34 49.82 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 114.87 -1.059 . . . . 71.120000000000005 110.016 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -162.95 91.2 0.72 Allowed 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 73.5 107.592 178.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.09 167.8 53.66 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 115.572 -0.74 . . . . 54.219999999999999 112.703 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.38 159.8 32.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.232 1.013 . . . . 63.030000000000001 111.476 -177.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.030000000000001 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.420000000000002 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 54.240000000000002 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 72.200000000000003 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.340000000000003 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 65.540000000000006 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.430000000000007 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m -99.95 111.46 23.76 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.040000000000006 110.743 -174.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 79.0 m -133.75 -68.88 0.55 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.385 1.074 . . . . 75.540000000000006 108.215 171.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -121.21 -50.03 2.15 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.571 0.748 . . . . 65.329999999999998 109.762 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -143.06 115.33 0.91 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 115.705 -0.68 . . . . 71.530000000000001 112.027 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -76.4 110.92 11.33 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.749 0.82 . . . . 64.319999999999993 109.776 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.9 p -104.38 -163.38 0.96 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.687 0.795 . . . . 72.340000000000003 109.408 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -66.38 -24.66 66.52 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.788 -0.57 . . . . 65.299999999999997 109.681 167.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 63.22 -80.54 0.03 OUTLIER 'General case' 0 C--N 1.361 1.091 0 C-N-CA 125.386 1.474 . . . . 73.540000000000006 111.482 175.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.547 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 -153.73 80.86 1.16 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.901 0.88 . . . . 75.340000000000003 108.693 176.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.219999999999999 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 70.310000000000002 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.099999999999994 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.040000000000006 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.530000000000001 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.465 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 62.530000000000001 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.453 ' HG3' ' HD3' ' A' ' 70' ' ' LYS . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.099999999999994 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 74.310000000000002 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.329999999999998 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 74.420000000000002 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.510000000000005 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.140000000000001 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.523 ' HB3' HG21 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 64.030000000000001 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.340000000000003 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.439999999999998 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.547 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.439999999999998 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HB2' HG13 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 63.329999999999998 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.530000000000001 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 54.310000000000002 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 74.530000000000001 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 71.0 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.439999999999998 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.400000000000006 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.030000000000001 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.510000000000005 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.427 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.430000000000007 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 63.32 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.431 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.519999999999996 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.61 ' HB ' HD21 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 63.350000000000001 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.340000000000003 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 72.019999999999996 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.439999999999998 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 52.329999999999998 110.226 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.540000000000006 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.230000000000004 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 61.119999999999997 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 70' ' ' LYS . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.310000000000002 111.83 176.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.406 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.329999999999998 110.511 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.420000000000002 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 64.120000000000005 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.4 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.209999999999994 111.252 -175.417 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 61.340000000000003 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.430000000000007 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 73.310000000000002 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.61 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.209999999999994 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.519999999999996 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 64.010000000000005 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.523 HG21 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 63.439999999999998 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.510000000000005 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 30.43 111.017 177.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 65.230000000000004 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.299999999999997 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.69 -121.11 1.06 Allowed Glycine 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.230000000000004 112.079 -172.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.495 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 52.7 m-85 -93.76 155.13 17.4 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.789 0.836 . . . . 74.329999999999998 109.859 -177.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 4.2 m-20 -61.79 -40.21 94.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.209 0.604 . . . . 70.310000000000002 110.158 -178.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.56 109.56 18.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.138 -0.937 . . . . 71.420000000000002 109.465 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm -125.05 138.9 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 70.299999999999997 107.281 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 64.010000000000005 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HA ' HG22 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.340000000000003 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.310000000000002 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.030000000000001 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.040000000000006 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.209999999999994 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 63.43 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 55.509999999999998 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.496 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 71.120000000000005 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.319999999999993 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.409999999999997 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 117.19 153.0 9.68 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 31.129999999999999 114.029 168.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -77.07 147.34 36.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.222 1.009 . . . . 74.209999999999994 110.389 178.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 26.0 tp -105.29 136.37 44.95 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.777 -1.194 . . . . 61.43 107.777 168.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -160.46 155.85 25.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.481 0.312 . . . . 71.129999999999995 110.81 -175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.88 -66.77 3.67 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.456 -0.658 . . . . 73.530000000000001 111.456 -179.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.8 p -119.02 142.39 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 124.023 0.929 . . . . 73.120000000000005 109.197 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.382 1.073 . . . . 75.230000000000004 108.698 176.71 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.729 -0.471 . . . . 71.109999999999999 109.729 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -74.65 118.46 17.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.436 0.694 . . . . 71.319999999999993 110.999 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -139.61 81.38 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 122.126 0.965 . . . . 72.409999999999997 109.313 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -135.79 -11.38 2.04 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 115.345 -0.843 . . . . 72.310000000000002 110.618 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 m80 -114.44 174.42 5.96 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.703 0.801 . . . . 74.450000000000003 109.423 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -84.2 110.24 18.38 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.151 0.58 . . . . 65.200000000000003 109.725 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -128.06 115.7 18.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.111 0.564 . . . . 74.510000000000005 110.741 -175.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.498 ' HG2' ' H ' ' A' ' 9' ' ' SER . 24.7 ttt180 -83.82 177.46 8.33 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 123.611 0.764 . . . . 74.409999999999997 109.127 172.134 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.498 ' H ' ' HG2' ' A' ' 8' ' ' ARG . 21.2 t 78.01 124.05 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.711 1.604 . . . . 74.349999999999994 109.668 -176.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 9.56 40.31 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.257 -0.883 . . . . 64.409999999999997 110.999 -164.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -73.85 159.77 32.39 Favored 'General case' 0 C--N 1.352 0.716 0 C-N-CA 124.501 1.121 . . . . 72.25 109.441 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.140000000000001 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.439999999999998 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 61.420000000000002 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' HG2' HG23 ' A' ' 28' ' ' THR . 28.0 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 62.329999999999998 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 4.1 t30 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.030000000000001 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.430000000000007 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 53.130000000000003 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p -104.76 131.5 52.14 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.030000000000001 110.883 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.3 t 63.24 40.85 8.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.233 1.413 . . . . 61.119999999999997 111.46 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -86.4 -159.5 0.49 Allowed 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.599 -0.728 . . . . 70.239999999999995 109.351 171.179 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.04 -150.91 4.8 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 112.309 -0.316 . . . . 71.140000000000001 112.309 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -85.59 -12.33 51.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.554 0.742 . . . . 73.230000000000004 110.678 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.9 m -60.46 129.47 41.78 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 123.978 0.911 . . . . 72.420000000000002 110.841 176.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -69.73 167.74 16.45 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.482 0.713 . . . . 75.129999999999995 111.642 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.71 135.1 47.48 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.736 1.214 . . . . 64.540000000000006 111.492 177.439 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.502 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 -82.55 87.83 6.67 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.535 0.734 . . . . 73.349999999999994 110.128 -171.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.585 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 52.420000000000002 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.539999999999999 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.230000000000004 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.407 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 74.450000000000003 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 53.200000000000003 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.537 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 71.219999999999999 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.329999999999998 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.430000000000007 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.537 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 72.510000000000005 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 72.549999999999997 111.523 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.530000000000001 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 74.319999999999993 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.209999999999994 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.310000000000002 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 71.209999999999994 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 73.409999999999997 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.51 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.120000000000005 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.510000000000005 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 51.219999999999999 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 62.240000000000002 109.979 176.31 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 65.420000000000002 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 72.340000000000003 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.439999999999998 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.430000000000007 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 62.409999999999997 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 71.019999999999996 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 61.240000000000002 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.150000000000006 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.140000000000001 108.634 177.008 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 73.530000000000001 109.474 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 73.040000000000006 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.299999999999997 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.404 ' HG3' HG23 ' A' ' 64' ' ' THR . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 73.099999999999994 112.531 -168.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 63' ' ' ARG . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 63.310000000000002 110.408 176.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.200000000000003 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 70.549999999999997 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 71.530000000000001 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 71.430000000000007 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.439999999999998 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.329999999999998 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.439999999999998 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 63.240000000000002 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 63.420000000000002 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 35.520000000000003 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.518 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 71.310000000000002 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.239999999999995 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.319999999999993 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.239999999999995 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 33.329999999999998 110.587 177.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.200000000000003 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 70.140000000000001 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -144.12 -133.29 2.67 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.349999999999994 111.245 -177.557 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 51.7 m-85 -93.92 166.23 12.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.365 0.666 . . . . 73.010000000000005 109.883 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -58.28 -43.03 87.78 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.457 0.703 . . . . 72.400000000000006 109.958 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB3' HD21 ' A' ' 102' ' ' LEU . 38.1 m-20 -80.26 121.06 25.16 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.78 -1.1 . . . . 55.409999999999997 109.527 176.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm -130.7 151.89 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 124.481 1.113 . . . . 73.049999999999997 109.628 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.129999999999995 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 72.25 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 51.130000000000003 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.420000000000002 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.420000000000002 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 61.109999999999999 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.319999999999993 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 25.440000000000001 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' VAL . . . . . 0.54 HG21 ' HB2' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.009999999999998 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.310000000000002 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 71.450000000000003 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 60.409999999999997 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.47 -151.14 49.3 Favored Glycine 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 72.530000000000001 114.361 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.21 143.54 12.24 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.1 0.56 . . . . 72.310000000000002 110.162 -173.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.582 ' H ' HD23 ' A' ' 102' ' ' LEU . 1.9 pt? -64.08 110.21 2.09 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.389 0.614 . . . . 71.010000000000005 110.042 174.076 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -94.35 132.58 38.82 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.829 0.852 . . . . 75.239999999999995 110.007 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 165.02 -80.31 0.12 Allowed Glycine 0 C--N 1.339 0.736 0 N-CA-C 110.712 -0.955 . . . . 65.310000000000002 110.712 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.9 m -101.17 153.47 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.671 0.788 . . . . 70.420000000000002 110.515 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 123.831 0.852 . . . . 73.540000000000006 109.099 178.871 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 109.879 -0.415 . . . . 70.299999999999997 109.879 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -147.97 -60.41 0.26 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.035 0.934 . . . . 65.109999999999999 110.14 176.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -85.23 52.55 2.48 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.57 0.748 . . . . 64.450000000000003 111.343 -173.732 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -81.75 130.7 35.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.439 0.696 . . . . 72.140000000000001 109.769 178.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 72.01 13.33 5.93 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.498 1.519 . . . . 61.43 112.249 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -72.89 -41.82 64.24 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.631 -0.877 . . . . 74.219999999999999 108.631 171.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -169.3 153.29 5.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.061 0.944 . . . . 64.420000000000002 108.883 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -87.93 97.67 11.07 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-O 121.416 0.627 . . . . 75.349999999999994 110.052 177.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 p -107.45 102.06 11.36 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.302 0.641 . . . . 62.439999999999998 109.618 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.13 62.03 0.02 OUTLIER Glycine 0 C--N 1.342 0.884 0 CA-C-N 115.741 -0.663 . . . . 53.210000000000001 111.989 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -69.88 145.99 51.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.140000000000001 110.519 178.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 72.109999999999999 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.510000000000005 108.967 172.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 64.530000000000001 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.209999999999994 109.161 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 61.409999999999997 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.329999999999998 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.430000000000007 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m -95.4 106.78 18.87 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 73.409999999999997 107.422 168.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 26.4 p -165.0 135.57 3.89 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.896 0.879 . . . . 32.530000000000001 109.212 -170.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.76 113.1 4.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.477 0.711 . . . . 72.349999999999994 110.553 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.14 154.13 6.42 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 110.907 -0.877 . . . . 63.340000000000003 110.907 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.9 -34.87 59.97 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.064 0.546 . . . . 71.120000000000005 110.961 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.4 p -97.79 92.93 6.09 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.189 0.596 . . . . 55.329999999999998 111.506 -175.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -137.05 17.19 3.01 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.15 0.98 . . . . 53.340000000000003 109.781 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.33 102.39 15.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.02 1.328 . . . . 74.230000000000004 109.158 -175.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -122.41 79.73 1.65 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.067 0.547 . . . . 74.349999999999994 109.778 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 62.149999999999999 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.450000000000003 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 62.020000000000003 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 61.109999999999999 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.340000000000003 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 74.439999999999998 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 73.430000000000007 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.420000000000002 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.510000000000005 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD11 HD13 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 70.5 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 73.420000000000002 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.109999999999999 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 51.329999999999998 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 63.450000000000003 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 54.109999999999999 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.420000000000002 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 64.450000000000003 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.230000000000004 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 74.5 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.319999999999993 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 62.229999999999997 110.878 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.430000000000007 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 64.540000000000006 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.149999999999999 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 62.420000000000002 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 51' ' ' GLN . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.019999999999996 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.340000000000003 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 71.010000000000005 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 42.140000000000001 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.340000000000003 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 72.120000000000005 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG21 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.150000000000006 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.465 HD13 HD11 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.409999999999997 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.040000000000006 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.209999999999994 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.45 ' H ' ' HD2' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.439999999999998 108.582 171.737 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 51.43 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.450000000000003 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 63.109999999999999 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.430000000000007 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 33.229999999999997 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 50.039999999999999 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.150000000000006 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.239999999999995 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.510000000000005 111.051 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 42.210000000000001 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.450000000000003 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.444 ' HB2' HG21 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 64.450000000000003 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.452 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 61.149999999999999 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 64.319999999999993 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.409999999999997 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 73.340000000000003 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.130000000000003 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.039999999999999 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 64.010000000000005 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.7 -114.67 0.72 Allowed Glycine 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.420000000000002 112.344 -175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -119.72 168.39 11.11 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.984 0.914 . . . . 74.040000000000006 110.757 -175.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -75.81 -8.59 57.23 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.886 0.874 . . . . 74.239999999999995 111.907 -177.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.55 ' HB3' ' HB2' ' A' ' 102' ' ' LEU . 7.7 m-20 -74.28 73.8 1.82 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.715 1.206 . . . . 61.43 110.764 -177.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm -130.12 125.99 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 122.979 0.512 . . . . 72.420000000000002 110.211 -171.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.349999999999994 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.452 ' HB ' HD11 ' A' ' 76' ' ' ILE . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 60.509999999999998 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 62.140000000000001 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 62.520000000000003 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.019999999999996 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.230000000000004 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.230000000000004 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' THR . . . . . 0.445 HG21 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.349999999999994 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 44.009999999999998 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.409999999999997 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.540000000000006 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.450000000000003 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 140.64 100.42 0.43 Allowed Glycine 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.129999999999995 112.878 173.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -91.57 113.03 25.19 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 107.55 -1.278 . . . . 62.229999999999997 107.55 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LEU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 86' ' ' ASP . 77.7 mt -75.97 116.75 16.98 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.569 0.748 . . . . 74.120000000000005 109.861 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.29 129.14 52.97 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.431 -0.951 . . . . 74.540000000000006 108.431 170.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.39 -127.01 2.72 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.072 -0.811 . . . . 64.0 111.072 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.92 152.78 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.846 0.858 . . . . 72.230000000000004 110.351 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 123.783 0.833 . . . . 55.210000000000001 109.573 173.103 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.242 0.692 0 CA-C-O 120.933 0.397 . . . . 75.41 110.766 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 70.34 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 72.3 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.02 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 71.54 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.33 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 73.44 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.43 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p . . . . . 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 61.01 109.235 177.891 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.439 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 . . . . . 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 64.04 108.561 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.4 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.21 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.22 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.14 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 62.13 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.451 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 73.1 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 71.41 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.3 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.451 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.43 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.31 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.31 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.1 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.13 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.45 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.12 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.13 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.15 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 71.23 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 71.31 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.24 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.14 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 62.34 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 72.41 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.22 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 34.4 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.22 109.83 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.31 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.3 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.31 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.438 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 73.21 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.48 ' HB ' HD21 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.42 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.22 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.45 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.2 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.461 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.43 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.21 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.34 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.54 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.32 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 63.43 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.4 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.34 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.33 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.44 ' HB3' HG21 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.34 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 54.0 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 78' ' ' VAL . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.31 110.465 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.48 HD21 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 73.11 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 55.13 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.41 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 52.04 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.31 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 63.22 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 45.44 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.21 109.256 177.729 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 73.3 108.984 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . 0.403 ' O ' HG13 ' A' ' 98' ' ' VAL . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 54.21 110.554 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.24 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 73.12 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.4 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.01 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 44.33 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB3' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 52.24 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 44.41 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 88' ' ' ASN . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.13 109.846 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.13 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 45.23 114.033 176.52 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 . . . . . 0 N--CA 1.477 0.91 0 CA-C-O 121.114 0.483 . . . . 74.34 110.609 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.549 HG21 HD22 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 64.31 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.21 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.2 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.55 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 62.24 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 52.3 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 70.23 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m . . . . . 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 64.24 108.257 -175.977 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 . . . . . 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.51 110.292 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.11 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 54.32 109.573 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.35 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.13 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.33 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.1 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' HE21 ' A' ' 38' ' ' GLN . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.03 111.634 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.42 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.522 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 62.12 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.549 HD22 HG21 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 63.31 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.512 HE21 ' HG2' ' A' ' 34' ' ' GLU . 71.9 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.21 111.713 -177.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.2 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 64.02 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 60' ' ' ILE . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.33 112.51 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.42 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 73.23 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.2 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.45 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 55.15 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.43 111.061 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 60.31 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.13 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 73.22 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 42.11 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.01 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.14 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.41 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.45 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.55 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 73.1 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 60.03 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HD21 ' A' ' 41' ' ' LEU . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 63.55 109.767 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.14 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.568 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 55.03 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.507 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.45 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 62.22 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.03 115.113 -168.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.55 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.33 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.42 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.13 111.389 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 73.12 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HD2' ' HB2' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.45 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.24 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.35 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.55 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 71.22 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 54.54 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.23 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 63.31 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.02 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.3 111.602 178.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 63.1 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 64.32 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.33 113.183 -174.333 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm . . . . . 0 N--CA 1.485 1.322 0 N-CA-C 110.053 -0.351 . . . . 73.53 110.053 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.21 110.536 -179.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 71.12 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.32 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 73.24 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 60.44 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 72.45 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.14 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 64.44 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.23 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 63.53 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.43 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.43 113.428 177.96 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 . . . . . 0 C--O 1.239 0.503 0 CA-C-O 121.063 0.458 . . . . 74.43 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.443 HG21 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 53.34 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 74.02 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 72.2 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.45 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.695 HD21 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.42 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.03 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.2 108.999 179.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.53 109.813 179.062 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.533 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 . . . . . 0 CA--C 1.549 0.931 0 N-CA-C 109.708 -0.478 . . . . 72.43 109.708 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.24 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 73.04 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 53.43 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 63.21 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.14 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.617 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.2 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.22 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.1 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.617 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 63.03 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 64.33 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.44 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.14 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 73.3 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.12 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 62.33 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.44 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 73.23 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.441 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 71.03 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.11 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 65.4 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.02 110.252 -178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 63.24 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 71.53 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 63.24 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 51.22 111.011 -178.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.44 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 70.11 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.44 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB2' HD21 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.14 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.42 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.54 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.469 ' HB3' HG23 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.21 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.24 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.43 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 73.21 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 55.05 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.54 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.14 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.42 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.22 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.41 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.45 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 51.41 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.493 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.43 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.2 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.41 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 64.44 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.412 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 72.41 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 52.15 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 62.25 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.497 ' HB3' HD12 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.15 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.45 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.24 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.35 110.405 171.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.45 111.579 175.245 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.497 HD12 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm . . . . . 0 N--CA 1.477 0.917 0 N-CA-C 110.233 -0.284 . . . . 74.52 110.233 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 74.15 111.212 -177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.12 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 63.34 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.12 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.23 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.31 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.24 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 61.15 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.493 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.44 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.469 HG23 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.12 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 72.42 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 61.53 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 70.05 114.984 168.481 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 110.337 -0.246 . . . . 75.43 110.337 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.576 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 70.35 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.13 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.491 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 36.6 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.43 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.417 HD21 ' HB2' ' A' ' 56' ' ' SER . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 54.33 108.56 174.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.8 OUTLIER -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.34 108.307 -179.138 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.45 110.062 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p . . . . . 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.04 108.214 172.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 . . . . . 0 N--CA 1.475 0.78 0 CA-C-O 119.669 -0.205 . . . . 75.11 111.18 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 63.25 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.21 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.51 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.54 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 61.43 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.562 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.42 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 74.41 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.465 ' H ' HG22 ' A' ' 33' ' ' THR . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.1 110.147 172.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.562 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 61.13 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.499 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 71.33 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 73.4 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.1 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.43 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.488 HD21 HD11 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 71.23 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.51 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.24 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 72.12 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 62.34 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 71.14 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.422 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 62.22 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 61.24 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.01 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.12 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 3.9 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.22 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 11.24 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.34 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 51.34 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' HD21 ' A' ' 16' ' ' ASN . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.23 109.517 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 52.12 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.606 ' HB ' HD21 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 55.23 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.44 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.499 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.4 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 72.52 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.52 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 65.32 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 73.02 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.55 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.44 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 71.41 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 62.43 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 70.23 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 62.51 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 73.01 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 72.41 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.13 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 71.45 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 54.23 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.606 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.53 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 72.51 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.23 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.04 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 65.3 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 41.53 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.43 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 40.34 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.41 109.444 -177.399 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 110.094 -0.336 . . . . 72.53 110.094 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.42 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 54.34 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 72.32 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.23 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 53.53 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.14 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.21 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.21 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 73.51 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 52.3 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 51.23 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.2 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.2 112.975 176.964 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 . . . . . 0 C--O 1.241 0.645 0 N-CA-C 109.969 -0.382 . . . . 74.4 109.969 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 54.52 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 53.43 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 73.25 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.442 ' HG2' HG23 ' A' ' 28' ' ' THR . 24.2 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.68 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 73.41 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 71.45 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' HE22 ' A' ' 51' ' ' GLN . 23.4 p-10 -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.14 109.902 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 33.2 m . . . . . 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.34 107.281 163.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.68 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 . . . . . 0 CA--C 1.558 1.271 0 CA-C-O 120.956 0.407 . . . . 74.51 110.895 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.442 HG23 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.34 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.23 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 74.02 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.31 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 60.43 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.15 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.43 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.52 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 71.23 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 71.24 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 65.41 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.34 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.13 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.23 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.01 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.11 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.35 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.52 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.42 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 72.33 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 73.23 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.41 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.413 HE22 ' ND2' ' A' ' 18' ' ' ASN . 10.5 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.23 110.594 176.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 54.22 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.22 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HD2' ' H ' ' A' ' 19' ' ' THR . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 72.21 110.002 174.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 64.13 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 71.24 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.44 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 75' ' ' LEU . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.4 110.385 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 65.14 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 63.15 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 52.32 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.42 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.01 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 65.35 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.33 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.55 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.57 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.15 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 71.12 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.33 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.474 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.13 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 44.11 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.33 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 64.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.32 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.12 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 61.23 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.21 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 73.3 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 64.31 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.03 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.24 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 35.55 110.797 177.772 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.546 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm . . . . . 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 70.25 109.562 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.21 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 72.41 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.44 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.4 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.41 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.13 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.672 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.21 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.43 ' HA ' ' H ' ' A' ' 62' ' ' ALA . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.23 111.143 -176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 52.53 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.22 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 64.13 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.32 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 73.34 111.698 170.071 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 . . . . . 0 N--CA 1.472 0.665 0 CA-C-O 121.135 0.493 . . . . 62.45 111.987 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.45 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 73.24 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 60.04 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 71.43 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.21 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.31 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 61.34 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.1 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.47 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p . . . . . 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 63.31 108.893 178.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 111.814 0.302 . . . . 63.23 111.814 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.2 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 73.51 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.4 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.51 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.33 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 35' ' ' SER . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 45.31 109.638 -178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 70.45 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.426 ' H ' HG22 ' A' ' 33' ' ' THR . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.3 111.177 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 60.13 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.31 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.54 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.14 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.24 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 63.42 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 51.22 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 71.43 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 63.22 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 61.11 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 64.34 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 55.42 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 74.4 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.589 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 74.55 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 73.11 111.931 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 17.3 mm100 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.14 112.726 -175.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.33 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.14 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.47 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 50.31 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.44 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 41.22 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 63.22 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' HD21 ' A' ' 75' ' ' LEU . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 70.12 109.312 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 74.33 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 72.2 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.45 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.33 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.23 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 70.12 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.13 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 62.14 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 71.2 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.35 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.31 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.3 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 72.21 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.42 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 42.42 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 44.42 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.15 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.433 HD21 ' HB ' ' A' ' 58' ' ' THR . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.34 111.496 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.539 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.45 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 72.14 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.04 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.34 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.34 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.13 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.589 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 73.12 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 71.52 110.638 -178.59 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 109.444 -0.576 . . . . 70.43 109.444 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.13 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.539 HG22 HD11 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.14 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.22 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.44 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.04 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.31 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.44 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.23 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 70.11 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.2 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 34.05 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.14 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.3 113.752 172.879 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.604 -0.517 . . . . 70.45 109.604 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 70.22 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.45 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 65.12 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 60.43 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.54 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 24.9 t-20 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.15 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.24 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.35 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 51.4 108.836 -175.774 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.54 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.884 0.373 . . . . 64.13 110.141 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.35 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.11 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 71.2 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.23 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.43 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.457 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 72.23 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.24 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.01 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.457 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.41 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 70.04 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 61.3 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.31 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.55 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HB3' HG21 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.43 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 60.45 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.44 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 60.41 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' O ' HD21 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 71.21 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.53 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.15 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 71.41 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.23 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 55.03 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.44 108.403 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.33 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 42.42 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 71.24 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 55.43 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.512 ' HB3' HD21 ' A' ' 16' ' ' ASN . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 62.12 108.186 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.02 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.42 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 61.34 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.02 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 73.32 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 62.31 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.417 ' HE ' ' HB2' ' A' ' 63' ' ' ARG . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.53 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 63.42 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 64.11 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.14 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 71.41 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 64.33 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 71.4 112.029 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.1 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 71.24 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.14 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.12 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.13 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.42 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.596 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.51 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.21 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.32 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.12 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 55.01 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 71.11 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.412 HD21 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.53 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.04 111.368 -177.627 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 109.835 -0.431 . . . . 71.32 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 65.33 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.596 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.53 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.13 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 65.43 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 62.21 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 65.5 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.03 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.1 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 61.41 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 72.35 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.32 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 52.24 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.43 115.871 -179.338 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 . . . . . 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.22 110.642 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.23 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.02 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.42 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.11 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 62.22 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.3 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 35.7 m-80 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 54.31 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 52.03 109.317 -176.695 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 73.2 110.491 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.15 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.11 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 71.33 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 63.54 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.23 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 35' ' ' SER . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.23 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.34 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.453 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 54.51 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.428 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 62.21 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.21 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.04 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 61.23 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 73.13 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.31 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 62.1 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 65.11 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 61.23 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 74.43 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.41 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 74.13 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 62.15 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.23 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.51 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.42 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.12 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.44 108.32 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 71.52 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 51.22 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.13 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 70.13 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 64.22 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.32 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.22 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.512 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 71.24 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 71.31 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.11 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 63.31 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.42 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.41 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.483 ' HA ' HG21 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.24 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 61.41 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.45 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.31 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.637 ' HB2' HG11 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.53 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 64.21 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 72.42 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.03 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 34.24 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.12 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 44.11 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.481 ' HB3' HD12 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.04 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.02 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.02 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.54 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 43.35 110.638 -179.202 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.481 HD12 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm . . . . . 0 CA--C 1.548 0.9 0 N-CA-C 110.816 -0.068 . . . . 72.1 110.816 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.02 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 61.41 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 71.32 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.3 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.42 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 71.1 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.23 109.989 174.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 50.22 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.637 HG11 ' HB2' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.05 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.34 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 54.11 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.4 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 42.23 112.269 175.855 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 . . . . . 0 C--O 1.241 0.606 0 N-CA-C 110.393 -0.225 . . . . 71.21 110.393 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.471 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.04 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.44 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 64.32 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.2 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.01 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.33 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.22 110.308 -173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m . . . . . 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 64.41 108.042 172.601 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.1 p90 . . . . . 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.21 110.223 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.42 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.33 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.43 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 72.25 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 71.02 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.35 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 72.43 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 64.33 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 73.13 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 60' ' ' ILE . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.1 110.771 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 63.3 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.22 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.22 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB3' HG21 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 44.0 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 70.22 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.22 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.01 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.1 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.23 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 74.23 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.32 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 70.21 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 71.1 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.1 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 21.32 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 63.41 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.14 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.12 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 51.55 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 73.44 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' HD21 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 72.51 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 54.42 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 37' ' ' LEU . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.31 109.739 -176.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.22 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 72.35 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.24 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 64.11 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 72.31 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 73.2 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 72.44 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.51 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 34.11 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.1 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 73.01 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.32 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 42.2 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 70.44 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.668 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.23 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.561 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 63.32 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 61.05 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.4 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 72.21 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 42.33 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.02 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.14 113.28 -175.154 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.402 ' HB ' HG13 ' A' ' 76' ' ' ILE . 48.2 mm . . . . . 0 N--CA 1.482 1.143 0 N-CA-C 109.595 -0.52 . . . . 54.15 109.595 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.12 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 51.04 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 64.41 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 72.13 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.12 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 43.23 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.54 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.14 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.54 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.572 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.12 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.13 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.425 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.32 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.52 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.43 112.736 178.073 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 . . . . . 0 N--CA 1.478 0.939 0 CA-C-O 121.532 0.682 . . . . 71.52 112.025 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.5 HG21 HD22 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 71.04 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 73.41 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 53.44 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 73.03 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.32 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 64.44 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.408 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.32 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 70.34 109.546 -177.902 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 . . . . . 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 72.34 109.02 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 70.0 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.24 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 50.11 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.12 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.24 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.34 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 73.54 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.12 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.4 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.43 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 54.54 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.13 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.32 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.597 HD21 HD11 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 71.1 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.23 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.15 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.04 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.52 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 63.05 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 63.34 111.524 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.31 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 62.0 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.23 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.12 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.12 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.456 ' HB2' HG23 ' A' ' 48' ' ' ILE . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.53 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.35 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 44.24 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 71.22 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.4 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 71.35 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 70.32 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.597 HD11 HD21 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 73.32 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 71.41 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 64.51 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 63.11 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 52.25 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.32 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.423 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 73.54 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.13 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.22 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 71.23 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.32 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.2 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.1 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.446 HD13 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.55 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 61.13 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 61.42 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.34 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 70.42 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.35 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 63.03 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 62.45 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 54.02 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.13 112.049 -179.08 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 100' ' ' GLY . 26.6 mm . . . . . 0 CA--C 1.541 0.602 0 N-CA-C 109.198 -0.668 . . . . 73.24 109.198 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 63.2 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 65.53 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 64.24 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 72.22 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.43 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 40.13 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.53 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.43 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 53.13 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 72.15 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.03 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.42 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 87' ' ' ILE . . . . . . . . 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 72.3 113.093 176.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 . . . . . 0 N--CA 1.474 0.738 0 CA-C-O 121.223 0.535 . . . . 73.33 110.525 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.1 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 61.31 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 71.54 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.31 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.653 HD21 HD11 ' A' ' 44' ' ' LEU . 15.8 m120 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 63.24 109.548 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 71.24 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.54 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p . . . . . 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.24 110.729 -174.795 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.624 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 . . . . . 0 N--CA 1.483 1.183 0 CA-C-O 121.019 0.438 . . . . 73.42 110.758 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 61.52 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.41 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.31 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 72.22 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.2 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.751 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 61.3 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 53.12 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.11 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.751 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.01 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.13 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 64.1 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 70.24 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.01 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 72.33 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.12 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.52 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.653 HD11 HD21 ' A' ' 16' ' ' ASN . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.1 110.635 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 64.02 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.52 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 72.2 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.24 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.1 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 63.05 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.624 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 63.12 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 65.12 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.15 108.747 172.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.21 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.448 ' NH2' ' H ' ' A' ' 100' ' ' GLY . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 65.11 110.121 -172.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.32 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.41 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 72.11 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.35 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 71.4 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.532 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 71.04 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.34 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.62 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.11 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 72.4 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 72.44 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 52.42 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 70.53 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 55.54 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.13 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 64.44 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.23 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 61.44 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 63.35 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.41 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.677 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 61.24 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 71.32 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.467 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.21 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.51 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.15 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.03 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 51.25 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.34 111.11 -177.636 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.526 HG21 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm . . . . . 0 N--CA 1.475 0.8 0 N-CA-C 109.023 -0.732 . . . . 70.31 109.023 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.53 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.677 HG22 HD11 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 53.41 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 64.33 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.23 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.32 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.41 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.62 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 62.01 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 74.32 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 41.33 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.42 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 74.33 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.627 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.448 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . . . . . . 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 32.22 110.66 -178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 121.106 0.479 . . . . 65.14 111.133 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.444 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.21 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 61.14 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.52 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 54.32 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.449 HD21 HD21 ' A' ' 44' ' ' LEU . 13.9 m120 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.3 109.827 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.12 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.34 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.8 p . . . . . 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.13 108.419 171.133 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 . . . . . 0 N--CA 1.472 0.641 0 CA-C-O 120.814 0.34 . . . . 73.34 111.703 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.45 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.413 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.43 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 55.42 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.02 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 73.24 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.1 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 71.21 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.33 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.05 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 70.32 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.54 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 62.44 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.12 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.11 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.52 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.449 HD21 HD21 ' A' ' 16' ' ' ASN . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 64.51 110.649 -173.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 52.54 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 55.31 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.23 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.42 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 60.55 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.05 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 64.13 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 72.12 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.52 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.21 108.027 172.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.51 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 60.32 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.45 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.4 HG21 HD11 ' A' ' 75' ' ' LEU . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.23 109.566 175.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 53.33 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 73.21 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 63.45 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 65.04 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 73.15 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.51 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.52 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 62.33 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.41 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.23 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 74.41 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 61.14 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.34 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.34 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.44 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 55.04 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.4 HD11 HG21 ' A' ' 58' ' ' THR . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 72.14 111.367 -176.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.1 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 64.11 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 62.04 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.24 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 45.44 110.502 176.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.43 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 62.13 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.34 112.722 -175.672 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.443 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 109.392 -0.596 . . . . 64.24 109.392 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 63.23 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.543 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 64.51 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 72.24 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.43 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 60.3 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.21 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.01 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 51.42 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 74.53 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 63.04 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.33 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.35 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 60.2 113.181 176.088 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.42 108.232 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.583 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 71.34 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.408 HE21 ' HB2' ' A' ' 15' ' ' GLN . 49.5 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.13 108.841 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.21 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.408 ' HB2' HE21 ' A' ' 13' ' ' GLN . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 60.13 108.46 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 65.5 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 53.23 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.51 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.2 p . . . . . 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.45 110.085 -175.639 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 . . . . . 0 N--CA 1.48 1.026 0 CA-C-O 121.012 0.434 . . . . 64.21 111.081 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 63.31 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 61.24 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.02 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.489 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.45 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 62.3 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.66 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.43 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.22 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.21 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.66 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.34 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 52.03 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.13 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 52.35 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.11 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.34 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.42 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.15 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.3 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 53.45 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.11 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.33 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.404 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 71.33 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 73.24 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 60.24 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 62.34 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.02 114.502 172.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 51.5 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 63.1 111.684 178.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 71.44 108.147 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 71.04 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.24 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.5 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.01 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 43.22 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 71.44 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.31 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 62.31 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.3 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 63.43 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 73.34 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.41 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.15 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.33 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.33 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.57 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.23 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.52 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 78' ' ' VAL . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.42 110.467 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.41 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 53.4 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 60.21 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 74' ' ' ILE . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 61.02 110.628 177.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.24 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.11 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.24 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 61.14 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 72.54 110.796 178.171 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.431 HG23 HG13 ' A' ' 98' ' ' VAL . 24.0 mm . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.599 0.238 . . . . 62.33 111.551 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 72.41 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.477 HG22 HD11 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.22 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 54.15 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.31 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.13 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.31 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 61.12 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.57 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.31 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.03 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 87' ' ' ILE . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.04 108.06 171.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.11 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.02 113.47 175.954 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 121.134 0.492 . . . . 64.52 109.789 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.32 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.23 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 73.15 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.11 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.692 HD21 HD21 ' A' ' 44' ' ' LEU . 16.4 m120 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 54.33 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 72.14 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 72.12 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 54.32 107.483 175.091 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 . . . . . 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.01 108.333 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 54.22 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.32 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.53 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 70.33 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 72.33 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.21 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.53 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.483 ' H ' HG22 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 70.41 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.24 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 73.44 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.34 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 72.12 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.4 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 64.34 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 71.01 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.04 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.692 HD21 HD21 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.4 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.54 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.34 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.22 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.42 HD11 ' ND2' ' A' ' 16' ' ' ASN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.21 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 64.53 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 53.11 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.03 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.52 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.45 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 72.33 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.2 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 60.53 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 65.53 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 62.44 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.3 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 64.4 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.23 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 62.03 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.662 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.33 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.43 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 73.13 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 64.22 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 55.3 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.41 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.41 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 73.02 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 51.11 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 61.43 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 44.5 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.445 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.45 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.57 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 64.41 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.2 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.24 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 72.33 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.3 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 70.4 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 73.12 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.45 111.165 176.65 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 63.52 108.024 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 54.14 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.57 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 62.45 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.34 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.31 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 72.32 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 33.14 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 65.45 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 71.32 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 63.41 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 72.3 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.31 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.42 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.3 112.499 167.421 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 C--O 1.242 0.687 0 CA-C-O 120.887 0.375 . . . . 70.1 110.799 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 71.41 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.1 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 72.34 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.23 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.05 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.4 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.44 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 70.52 108.384 171.954 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 . . . . . 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.41 108.423 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.24 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.15 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.13 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.409 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.33 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 62.1 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 64.11 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.42 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.34 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.23 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 63.24 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.31 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.51 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 62.31 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.01 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.24 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.15 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.52 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.22 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.1 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 64.15 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.448 HG23 ' SG ' ' A' ' 53' ' ' CYS . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 62.43 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 72.3 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 71.42 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 26.3 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.34 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 61.54 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.614 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.22 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 63.21 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.33 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 64.21 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 73.13 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.24 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.31 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 63.11 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.593 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 63.35 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.11 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 72.52 110.245 -169.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.45 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.43 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 61.41 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 54.41 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.04 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.05 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.54 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 30.31 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.35 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 71.52 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.53 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.616 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.12 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HD2' HG22 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.1 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.501 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 70.33 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 65.22 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 71.21 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 65.43 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.23 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.616 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm . . . . . 0 N--CA 1.472 0.646 0 N-CA-C 109.44 -0.578 . . . . 72.31 109.44 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 53.25 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.521 ' HB ' HG22 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 71.41 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 64.44 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.14 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 43.11 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.55 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.4 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.32 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.3 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 52.11 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.521 HG22 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 54.33 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.34 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.43 113.508 171.454 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 . . . . . 0 C--O 1.242 0.702 0 N-CA-C 109.905 -0.406 . . . . 73.24 109.905 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.22 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.43 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.4 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.3 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.32 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.31 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 70.05 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t . . . . . 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 62.04 109.986 177.058 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 . . . . . 0 N--CA 1.48 1.058 0 CA-C-O 121.36 0.6 . . . . 71.03 109.45 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.44 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.41 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.21 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 63.41 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.21 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.43 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 62.31 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 54.22 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.4 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD11 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.24 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 71.43 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 35' ' ' SER . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.12 110.879 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.45 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.409 ' HB3' HG21 ' A' ' 78' ' ' VAL . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.41 113.309 -170.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 55.22 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 71.35 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.35 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 64.4 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.11 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 72.15 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 73.03 109.359 175.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.12 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.31 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 63.53 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 63.1 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 61.22 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 61.31 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.401 HH22 HD13 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.01 107.851 172.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 53.54 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.22 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 64.53 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.436 HG12 HG22 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 62.41 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 72.45 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 52.24 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.4 113.368 -169.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.55 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 62.12 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.03 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 63.43 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 62.41 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.3 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 60.5 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 64.41 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 55.02 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 50.34 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 33.54 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.411 HD22 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.24 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.476 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.23 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.41 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 52.1 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . 0.484 ' HB3' HD12 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.22 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 51.5 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.55 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 71.13 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.42 113.44 -179.218 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.484 HD12 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.3 107.71 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 62.2 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.476 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 54.24 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.2 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 71.25 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.44 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.01 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.23 110.113 176.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.44 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 62.25 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.12 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 73.13 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.43 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.02 113.166 170.819 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 121.154 0.502 . . . . 73.22 111.925 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 65.55 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.1 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.41 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.53 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.508 ' HB2' HD21 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.1 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 63.44 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' SG ' ' A' ' 53' ' ' CYS . 85.2 m-20 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.01 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.53 108.534 -179.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 . . . . . 0 N--CA 1.482 1.157 0 N-CA-C 112.055 0.391 . . . . 75.13 112.055 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 72.34 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.24 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 53.31 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.425 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 61.43 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.02 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 51.22 111.795 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 55.32 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.464 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 64.45 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 62.24 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.34 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 54.21 111.324 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.23 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.03 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.508 HD21 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 61.32 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 71.43 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.12 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.11 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.14 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.41 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 64.35 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 73.43 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 62.11 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.413 ' SG ' ' ND2' ' A' ' 18' ' ' ASN . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.22 109.964 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 72.35 110.551 -178.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 71.32 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 60.32 111.2 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 64.05 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.411 ' HB ' HD11 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 41.54 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.23 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 72.21 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 50.1 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.12 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.622 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 64.41 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 72.24 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.472 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.24 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.33 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.31 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.481 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.03 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.23 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 70.14 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.34 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.15 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.05 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 52.11 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.411 HD11 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.34 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.536 HD11 HG22 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 61.04 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.13 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.415 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 71.44 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.33 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 62.21 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.13 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 61.14 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.02 111.898 -176.565 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 120.571 0.224 . . . . 75.13 110.951 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 62.01 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.536 HG22 HD11 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 61.13 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.14 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . 0.472 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.52 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.02 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 40.13 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.622 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.12 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.11 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 40.25 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 54.03 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 73.13 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.25 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.14 111.943 179.143 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 . . . . . 0 N--CA 1.476 0.828 0 CA-C-O 121.114 0.483 . . . . 63.03 111.476 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.03 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.42 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 54.24 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 72.2 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.34 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 65.54 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.43 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m . . . . . 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.04 110.743 -174.436 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.547 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 . . . . . 0 CA--C 1.538 0.506 0 N-CA-C 108.693 -0.855 . . . . 75.34 108.693 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.22 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 70.31 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.1 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.04 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.53 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.465 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 62.53 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.453 ' HG3' ' HD3' ' A' ' 70' ' ' LYS . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.1 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 74.31 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.33 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 74.42 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.51 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.14 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.523 ' HB3' HG21 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 64.03 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.34 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.44 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.547 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.44 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HB2' HG13 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 63.33 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.53 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 54.31 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 74.53 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 71.0 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.44 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.4 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.03 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.51 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.427 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.43 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 63.32 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.431 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.52 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.61 ' HB ' HD21 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 63.35 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.34 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 72.02 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.44 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 52.33 110.226 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.54 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.23 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 61.12 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 70' ' ' LYS . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.31 111.83 176.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.406 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.33 110.511 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.42 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 64.12 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.4 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.21 111.252 -175.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 61.34 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.43 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 73.31 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.61 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.21 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.52 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 64.01 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.523 HG21 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 63.44 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.51 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 30.43 111.017 177.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 65.23 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.3 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.23 112.079 -172.925 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 70.3 107.281 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 64.01 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HA ' HG22 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.34 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.31 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.03 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.04 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.21 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 63.43 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 55.51 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.496 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 71.12 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.32 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.41 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 31.13 114.029 168.027 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.471 0.584 0 N-CA-C 109.441 -0.577 . . . . 72.25 109.441 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.14 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.44 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 61.42 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.585 ' HG2' HG23 ' A' ' 28' ' ' THR . 98.9 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 62.33 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 25.1 t-20 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.03 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.43 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 53.13 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p . . . . . 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.03 110.883 -173.579 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.502 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 . . . . . 0 CA--C 1.542 0.659 0 CA-C-O 121.21 0.528 . . . . 73.35 110.128 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.585 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 52.42 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.54 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.23 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.407 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 74.45 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 53.2 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . 0.537 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 71.22 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.33 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.43 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.537 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 72.51 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 72.55 111.523 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.53 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 74.32 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.21 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.31 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 71.21 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 73.41 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.35 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.51 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.12 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.51 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 51.22 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 62.24 109.979 176.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 65.42 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 72.34 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.44 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.43 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 62.41 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 71.02 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 61.24 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.15 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.14 108.634 177.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 73.53 109.474 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 73.04 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.3 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.404 ' HG3' HG23 ' A' ' 64' ' ' THR . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 73.1 112.531 -168.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 63' ' ' ARG . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 63.31 110.408 176.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.2 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 70.55 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 71.53 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 71.43 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.44 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.33 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.44 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 63.24 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 63.42 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 35.52 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.518 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 71.31 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.24 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.32 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.24 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 33.33 110.587 177.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.2 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 70.14 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.35 111.245 -177.557 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 109.628 -0.508 . . . . 73.05 109.628 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.13 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 72.25 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 51.13 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.42 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.42 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 61.11 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.32 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 25.44 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . 0.54 HG21 ' HB2' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.01 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.31 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 71.45 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 60.41 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 72.53 114.361 170.992 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.14 110.519 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 72.11 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.437 HE21 ' HB2' ' A' ' 15' ' ' GLN . 38.9 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.51 108.967 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 64.53 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLN . . . . . 0.437 ' HB2' HE21 ' A' ' 13' ' ' GLN . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.21 109.161 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 61.41 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.33 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.43 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m . . . . . 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 73.41 107.422 168.977 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 . . . . . 0 N--CA 1.478 0.975 0 N-CA-C 109.778 -0.453 . . . . 74.35 109.778 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 62.15 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.45 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 62.02 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 61.11 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.34 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 74.44 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 73.43 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.42 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.51 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.465 HD11 HD13 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 70.5 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 73.42 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.11 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 51.33 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 63.45 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 54.11 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.42 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 64.45 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.23 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 74.5 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.32 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 62.23 110.878 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.43 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 64.54 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.15 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 62.42 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 51' ' ' GLN . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.02 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.34 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 71.01 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 42.14 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.34 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 72.12 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG21 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.15 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.465 HD13 HD11 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.41 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.04 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.21 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.45 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.44 108.582 171.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 51.43 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.45 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 63.11 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.43 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 33.23 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 50.04 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.15 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.24 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.51 111.051 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 42.21 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.45 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.444 ' HB2' HG21 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 64.45 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.452 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 61.15 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 64.32 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.41 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 73.34 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.13 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.04 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 64.01 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.42 112.344 -175.675 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm . . . . . 0 N--CA 1.478 0.926 0 N-CA-C 110.211 -0.292 . . . . 72.42 110.211 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.35 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.452 ' HB ' HD11 ' A' ' 76' ' ' ILE . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 60.51 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 62.14 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 62.52 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.02 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.23 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.23 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' THR . . . . . 0.445 HG21 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.35 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 44.01 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.41 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.54 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.45 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.13 112.878 173.495 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 ttt . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.702 -0.481 . . . . 52.13 109.702 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 81.0 m-70 -121.58 -69.29 0.84 Allowed 'General case' 0 N--CA 1.48 1.027 0 N-CA-C 108.054 -1.091 . . . . 74.22 108.054 170.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 61.9 t-80 56.68 66.58 1.15 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.906 1.282 . . . . 70.52 111.213 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.1 p-80 -65.0 143.46 57.94 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 109.88 -0.415 . . . . 74.21 109.88 176.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -67.44 89.17 0.22 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-O 121.554 0.692 . . . . 71.33 110.322 -178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 16.9 p-80 -99.47 160.11 14.53 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.188 0.995 . . . . 62.05 110.181 -178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.3 m-70 -93.52 -3.62 52.56 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.674 -0.694 . . . . 62.5 111.025 174.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -60.81 95.78 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.13 0.572 . . . . 62.32 109.871 175.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.6 m -68.55 130.28 42.4 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.873 0.869 . . . . 63.21 110.908 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.56 -25.26 0.18 Allowed Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.518 -0.633 . . . . 71.44 111.518 -174.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -79.68 162.72 25.05 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 123.773 0.829 . . . . 75.41 110.766 177.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.46 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 42.7 mt -86.9 103.14 12.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.779 0 CA-C-N 115.307 -0.861 . . . . 70.34 108.743 174.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 tt0 -90.56 109.72 20.87 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 108.883 -0.784 . . . . 72.3 108.883 173.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.452 ' O ' ' HA ' ' A' ' 28' ' ' THR . 56.3 t -97.84 108.54 21.97 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 C-N-CA 124.372 1.069 . . . . 75.02 108.537 175.742 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -119.22 117.95 29.99 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 118.665 0.666 . . . . 71.54 109.816 -179.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.422 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 26.6 t-20 -102.99 116.97 33.56 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.82 -0.437 . . . . 63.33 109.82 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -103.14 111.18 23.42 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.475 1.11 . . . . 73.44 108.145 172.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.2 p30 -119.78 147.54 44.51 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.325 0.65 . . . . 75.43 110.171 -177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.4 p -107.55 111.43 23.69 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.431 0.692 . . . . 61.01 109.235 177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.416 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 46.1 m -146.12 -49.85 0.22 Allowed 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.595 1.158 . . . . 64.31 108.426 -175.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.577 ' HB3' ' HE2' ' A' ' 25' ' ' PHE . 22.8 t-20 -144.3 -39.55 0.28 Allowed 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 113.986 -1.461 . . . . 74.32 107.949 173.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 179.03 -171.72 43.81 Favored Glycine 0 C--N 1.344 1.027 0 CA-C-N 115.048 -0.978 . . . . 71.33 111.612 172.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.5 ttpp -78.96 4.16 15.06 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.945 0.898 . . . . 74.21 110.811 178.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.8 t -61.03 -19.29 61.19 Favored 'General case' 0 CA--C 1.559 1.319 0 C-N-CA 123.685 0.794 . . . . 50.04 111.216 170.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.577 ' HE2' ' HB3' ' A' ' 21' ' ' ASN . 90.5 m-85 -96.86 22.48 8.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.371 1.068 . . . . 70.13 111.565 175.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.3 p-10 -63.45 146.73 53.01 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 119.362 0.983 . . . . 73.02 110.83 -176.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.439 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 35.2 m-85 -123.84 83.01 2.08 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 108.561 -0.903 . . . . 64.04 108.561 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 24.8 m -107.11 117.07 33.08 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 115.887 -0.597 . . . . 72.4 110.688 -178.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -119.19 150.65 39.71 Favored 'General case' 0 C--O 1.235 0.313 0 C-N-CA 124.925 1.29 . . . . 74.21 108.121 177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 22.9 m -129.62 105.73 8.26 Favored 'General case' 0 N--CA 1.468 0.443 0 N-CA-C 108.759 -0.83 . . . . 71.22 108.759 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 32.8 m -113.61 171.88 3.73 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.85 0.86 . . . . 74.14 110.029 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.1 t -131.89 6.79 4.33 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.155 0.582 . . . . 62.13 110.515 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.451 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 63.0 m -137.94 141.4 40.56 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.534 0.734 . . . . 73.1 110.095 -174.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -65.09 -32.9 74.83 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 124.329 1.052 . . . . 71.41 111.599 -178.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.2 m -66.51 -43.43 85.3 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 122.879 0.472 . . . . 71.3 110.483 176.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.451 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 24.8 mm-40 -67.44 -31.07 71.0 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.733 -0.667 . . . . 73.43 110.575 177.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 64.6 tp -63.7 -48.11 78.43 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.556 0.742 . . . . 72.31 110.007 174.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -60.39 -39.64 88.03 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.824 0.849 . . . . 72.31 110.952 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -64.33 -51.46 63.32 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 123.95 0.9 . . . . 73.1 111.36 179.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 32.8 m -71.54 -27.13 27.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 CA-C-O 119.259 -0.4 . . . . 72.13 111.988 -175.152 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.439 ' HB3' HG21 ' A' ' 78' ' ' VAL . 68.0 mt -76.59 -37.83 55.86 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.342 0.657 . . . . 71.45 111.31 176.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 49.4 t30 -63.04 -37.82 88.7 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.511 0.724 . . . . 75.12 110.226 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -77.3 -39.7 47.02 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 114.616 -1.175 . . . . 74.13 110.847 178.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 tt -60.69 -38.84 86.31 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.306 1.043 . . . . 75.15 109.56 177.645 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HB2' HG13 ' A' ' 78' ' ' VAL . 37.1 ttpt -57.24 -45.64 83.75 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.148 1.379 . . . . 71.23 111.275 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.49 -34.55 75.66 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.172 0.989 . . . . 71.31 111.105 179.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.439 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 46.5 m-85 -69.94 -47.17 63.43 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.244 0.618 . . . . 74.24 111.985 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.0 mt -60.13 -41.37 86.35 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 N-CA-C 109.739 -0.467 . . . . 71.14 109.739 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.4 ttpt -59.92 -43.58 94.81 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.739 1.215 . . . . 62.34 111.599 176.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -69.66 -45.5 68.24 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.611 0.764 . . . . 72.41 111.243 -174.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -78.49 163.62 25.43 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 115.819 -0.628 . . . . 73.22 110.954 178.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -83.64 57.87 5.04 Favored Glycine 0 C--N 1.346 1.136 0 CA-C-N 115.786 -0.643 . . . . 34.4 111.904 174.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.416 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 59.5 m -76.02 103.16 5.94 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.492 0.717 . . . . 63.22 109.83 -179.312 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.7 mtmt -58.71 -51.35 70.34 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.816 0.698 . . . . 73.31 109.22 173.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -154.15 151.71 29.56 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 114.552 -1.204 . . . . 74.3 109.779 170.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 69.8 p -136.79 154.5 50.53 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 124.122 0.969 . . . . 71.31 109.128 -178.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.438 ' HB3' ' HB2' ' A' ' 99' ' ' GLU . 9.7 ptp85 -127.77 115.73 19.12 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 109.361 -0.607 . . . . 73.21 109.361 175.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.48 ' HB ' HD21 ' A' ' 75' ' ' LEU . 20.1 m -97.94 125.18 42.73 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 108.331 -0.989 . . . . 73.42 108.331 175.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 32.5 m -105.87 118.56 36.9 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 123.998 0.919 . . . . 74.22 108.779 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.44 HG21 ' HB3' ' A' ' 71' ' ' PHE . 57.1 mt -115.31 131.22 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.155 0 C-N-CA 123.503 0.721 . . . . 72.45 109.239 -179.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.46 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 40.2 m -63.4 120.04 10.88 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.0 0.52 . . . . 61.2 111.008 -179.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.461 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -153.58 88.21 1.27 Allowed 'General case' 0 C--O 1.222 -0.383 0 C-N-CA 124.452 1.101 . . . . 75.43 108.407 -177.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -80.27 -36.15 34.92 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.169 0.587 . . . . 75.21 110.941 -172.165 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 82.4 p -94.08 160.71 14.59 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 122.552 0.341 . . . . 71.34 110.136 176.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 43.5 mtmt -66.89 -29.89 69.9 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.375 0.67 . . . . 74.54 110.75 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 mtpp -58.65 -48.46 80.96 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.83 0.852 . . . . 75.32 110.666 175.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.448 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 55.8 mt-10 -68.82 -34.04 74.85 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 115.039 -0.982 . . . . 63.43 111.11 178.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.76 -19.11 65.77 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.827 0.851 . . . . 71.4 112.158 176.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.7 mm-40 -86.56 -58.92 2.43 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 123.438 0.695 . . . . 64.34 111.016 173.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.448 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -70.35 -48.88 54.37 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.676 0.79 . . . . 74.33 112.863 -168.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.44 ' HB3' HG21 ' A' ' 60' ' ' ILE . 23.3 m-30 -71.4 -35.61 71.08 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.024 0.53 . . . . 75.34 110.673 -177.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -64.62 -43.85 92.41 Favored 'General case' 0 C--N 1.345 0.376 0 CA-C-N 115.233 -0.894 . . . . 75.25 110.731 177.148 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.02 -48.15 73.77 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.33 0.652 . . . . 54.0 111.361 -177.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' O ' HG23 ' A' ' 78' ' ' VAL . 61.9 mt -56.41 -39.69 62.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 123.991 0.917 . . . . 75.31 110.465 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.48 HD21 ' HB ' ' A' ' 58' ' ' THR . 25.8 tp -75.14 -33.63 61.55 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.467 0.707 . . . . 73.11 111.966 -176.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.6 -36.05 75.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 N-CA-C 109.17 -0.678 . . . . 55.13 109.17 174.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.408 ' O ' ' HG3' ' A' ' 81' ' ' GLU . 1.1 mpmm? -62.19 -47.99 82.02 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.027 0.531 . . . . 75.41 110.725 173.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.577 HG13 ' HB2' ' A' ' 45' ' ' LYS . 80.2 t -52.7 -48.1 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 C-N-CA 124.091 0.956 . . . . 52.04 111.277 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -71.56 -32.98 68.7 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 114.94 -1.027 . . . . 65.31 111.785 179.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -71.74 -23.14 61.56 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 122.719 0.408 . . . . 63.22 111.517 -179.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 77' ' ' LYS . 42.0 mt-10 -81.18 -32.08 33.73 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.253 0.621 . . . . 73.0 110.803 176.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.3 mt -80.89 -23.12 39.22 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.79 0.836 . . . . 45.44 111.389 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.76 106.38 0.29 Allowed Glycine 0 C--N 1.334 0.437 0 N-CA-C 109.256 -1.538 . . . . 75.21 109.256 177.729 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 90.0 m-85 -74.75 70.9 1.92 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.113 0.965 . . . . 64.2 110.237 -174.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -132.79 178.79 6.59 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.209 -1.36 . . . . 74.13 108.609 -173.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -69.06 136.23 52.02 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 108.321 -0.992 . . . . 74.43 108.321 163.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 35.9 mm -114.96 143.92 23.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 N-CA-C 108.984 -0.747 . . . . 73.3 108.984 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.736 ' HB2' ' HA ' ' A' ' 101' ' ' GLN . 46.8 t30 -90.05 135.86 33.4 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.933 0.493 . . . . 54.21 110.554 179.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.7 p -114.5 107.87 23.99 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.782 0 N-CA-C 108.407 -0.96 . . . . 73.5 108.407 172.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 91.6 m -117.98 120.94 39.34 Favored 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 123.647 0.779 . . . . 62.32 109.329 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.5 t90 -122.11 125.03 45.28 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.097 0.959 . . . . 74.24 108.904 179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -83.19 -36.69 24.48 Favored 'General case' 0 N--CA 1.477 0.909 0 O-C-N 123.293 0.37 . . . . 73.12 110.576 -176.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 152.54 -18.17 0.78 Allowed Glycine 0 C--N 1.347 1.14 0 CA-C-O 119.955 -0.358 . . . . 70.4 113.129 -177.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.424 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 29.9 t70 -135.27 -22.78 1.52 Allowed 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 117.16 0.48 . . . . 55.01 111.095 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.8 m -144.88 134.32 23.15 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 122.796 0.438 . . . . 44.33 110.31 -174.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.461 HG23 ' HB3' ' A' ' 62' ' ' ALA . 47.7 t -92.07 113.32 27.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 N-CA-C 109.33 -0.619 . . . . 52.24 109.33 176.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 56.4 m -107.1 111.95 24.64 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 109.02 -0.733 . . . . 44.41 109.02 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.403 HG13 ' O ' ' A' ' 88' ' ' ASN . 48.0 t -98.42 114.37 35.78 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 123.757 0.823 . . . . 75.13 109.846 -178.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.438 ' HB2' ' HB3' ' A' ' 57' ' ' ARG . 1.8 tm-20 -152.58 133.35 13.98 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 123.362 0.665 . . . . 65.13 109.613 179.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 66.73 -147.65 49.83 Favored Glycine 0 C--N 1.349 1.255 0 O-C-N 124.031 0.832 . . . . 45.23 114.033 176.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.736 ' HA ' ' HB2' ' A' ' 88' ' ' ASN . 0.0 OUTLIER -151.03 137.38 18.54 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.662 -0.866 . . . . 73.21 108.662 175.954 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 35.8 tp -70.22 134.49 48.11 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.535 0.734 . . . . 71.4 110.13 178.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -136.89 156.87 47.91 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.785 0.834 . . . . 71.05 110.132 -179.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 64.34 -95.2 0.17 Allowed Glycine 0 C--N 1.35 1.319 0 O-C-N 123.654 0.596 . . . . 51.21 112.83 178.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 39.9 t -69.36 107.03 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.348 0.539 0 N-CA-C 108.549 -0.908 . . . . 64.3 108.549 176.229 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.0 t70 . . . . . 0 C--O 1.244 0.808 0 N-CA-C 108.96 -0.756 . . . . 74.33 108.96 -178.756 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.557 ' HB2' ' HB3' ' A' ' 92' ' ' ASP . 1.6 mpt? . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.968 -0.382 . . . . 54.24 109.968 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -146.83 85.2 1.62 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.036 0.934 . . . . 63.22 108.962 173.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -141.68 109.12 5.58 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.038 0.535 . . . . 65.41 110.171 -175.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -128.22 135.38 49.61 Favored 'General case' 0 N--CA 1.48 1.028 0 N-CA-C 108.321 -0.992 . . . . 44.32 108.321 176.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -148.76 113.69 5.44 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.632 0.773 . . . . 61.53 109.231 -174.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 17.7 t60 -117.85 79.18 1.32 Allowed 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.806 0.813 . . . . 71.54 109.068 176.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -86.03 -27.78 24.56 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 115.123 -0.944 . . . . 74.3 108.964 166.621 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.2 mmm180 -130.25 169.85 14.87 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 125.55 1.54 . . . . 74.24 108.708 -179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.4 p -67.01 -47.26 72.0 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 108.452 -0.944 . . . . 73.24 108.452 168.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.65 151.68 4.1 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 114.924 -1.035 . . . . 74.2 113.58 172.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -74.75 154.17 38.49 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.415 0.686 . . . . 74.34 110.609 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.549 HG21 HD22 ' A' ' 37' ' ' LEU . 66.0 mt -95.47 103.55 14.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 108.524 -0.917 . . . . 64.31 108.524 174.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -89.88 132.09 35.46 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.914 -0.773 . . . . 75.21 108.914 173.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 20.3 t -120.69 108.46 22.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.821 1.248 . . . . 72.2 107.956 -175.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.7 mm-40 -103.75 149.97 24.51 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.834 0.853 . . . . 74.55 109.786 178.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.495 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 23.6 t-20 -144.32 115.29 7.85 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 109.711 -0.477 . . . . 62.24 109.711 171.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -103.14 111.0 23.16 Favored 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 107.951 -1.129 . . . . 52.3 107.951 174.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.4 t-20 -110.53 143.11 41.38 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.984 -0.747 . . . . 70.23 108.984 -177.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.7 m -108.33 110.58 22.19 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 124.466 1.107 . . . . 64.24 108.257 -175.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 52.1 t -162.65 82.0 0.51 Allowed 'General case' 0 C--O 1.241 0.655 0 N-CA-C 108.048 -1.093 . . . . 71.02 108.048 -172.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -60.32 103.74 0.26 Allowed 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.9 0.88 . . . . 71.15 110.095 -175.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 146.88 -51.34 0.58 Allowed Glycine 0 C--O 1.241 0.537 0 CA-C-N 114.804 -1.089 . . . . 72.51 110.488 -178.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tppp? -162.93 127.24 3.0 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 122.971 0.509 . . . . 71.12 110.624 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 21.4 p -132.92 101.6 5.31 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.604 1.161 . . . . 74.41 109.033 176.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -73.18 105.56 4.66 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.819 -0.808 . . . . 65.41 108.819 171.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -82.29 142.17 32.3 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.791 0.836 . . . . 75.52 110.422 178.12 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -142.77 82.86 1.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 CA-C-O 121.763 0.792 . . . . 75.51 110.292 -173.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 23.6 m -89.63 122.67 32.99 Favored 'General case' 0 C--N 1.349 0.559 0 CA-C-N 115.017 -0.992 . . . . 73.11 109.374 175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.03 147.4 37.28 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.158 0.583 . . . . 54.32 109.573 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 38.0 m -130.86 105.78 8.0 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 107.449 -1.315 . . . . 64.35 107.449 170.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.472 HG21 ' HB2' ' A' ' 37' ' ' LEU . 27.0 m -110.95 128.83 67.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 C-N-CA 123.803 0.841 . . . . 72.13 109.384 -178.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.8 t -86.57 -19.3 29.61 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.285 0.634 . . . . 73.33 110.308 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.522 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 30.1 m -112.83 129.15 56.55 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.868 0.867 . . . . 72.1 109.178 178.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.512 ' HG2' HE21 ' A' ' 38' ' ' GLN . 31.6 tt0 -65.53 -31.97 73.32 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.015 0.926 . . . . 73.03 111.634 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 35.2 m -57.44 -32.59 67.06 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.331 0.652 . . . . 73.42 111.057 176.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.522 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 42.3 mm-40 -68.99 -45.84 69.58 Favored 'General case' 0 C--N 1.349 0.582 0 CA-C-N 115.715 -0.675 . . . . 62.12 110.429 175.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.549 HD22 HG21 ' A' ' 12' ' ' ILE . 68.2 tp -55.68 -43.43 76.38 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.968 0.907 . . . . 63.31 111.867 178.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.512 HE21 ' HG2' ' A' ' 34' ' ' GLU . 71.9 mt-30 -57.81 -34.27 69.47 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.945 0.898 . . . . 75.21 111.713 -177.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -80.41 -42.39 22.84 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.533 0.733 . . . . 70.2 110.186 175.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.0 t -55.93 -35.31 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.209 0 C-N-CA 124.427 1.091 . . . . 64.02 111.365 -178.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 60' ' ' ILE . 95.6 mt -64.49 -24.71 67.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.301 0.64 . . . . 75.33 112.51 -178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 74.2 m-20 -77.48 -44.06 30.14 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.486 0.714 . . . . 64.42 110.936 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -68.4 -43.79 76.48 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.026 0.53 . . . . 73.23 110.152 175.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 tt -58.13 -42.43 85.78 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.563 1.145 . . . . 64.2 110.448 177.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 40.6 ttpt -60.99 -39.98 91.72 Favored 'General case' 0 CA--C 1.546 0.823 0 O-C-N 124.273 0.983 . . . . 74.45 111.072 176.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -39.61 89.87 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.769 0.828 . . . . 55.15 110.922 178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -69.24 -41.03 77.52 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.16 0.584 . . . . 74.43 111.061 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 66.2 mt -62.35 -47.54 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.62 0.768 . . . . 60.31 109.665 176.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -54.03 -54.45 39.07 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 125.147 1.379 . . . . 74.13 111.315 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -65.06 -42.9 93.76 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 114.658 -1.156 . . . . 73.22 111.377 -176.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -95.39 12.47 29.1 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.318 0.647 . . . . 71.25 111.822 -175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -75.35 71.79 1.75 Allowed Glycine 0 N--CA 1.475 1.234 0 O-C-N 123.113 0.258 . . . . 42.11 113.547 -175.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.75 -67.86 0.74 Allowed 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.799 0.84 . . . . 64.01 110.444 -178.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -113.4 -66.8 1.05 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.762 0.425 . . . . 75.14 110.364 176.722 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 17.8 ttm180 -130.49 148.34 52.28 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 122.599 0.359 . . . . 74.41 110.961 -171.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.9 p -138.06 125.35 21.74 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 107.775 -1.194 . . . . 64.45 107.775 168.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 32.1 ttm180 -118.28 119.85 35.89 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 108.077 -1.083 . . . . 73.55 108.077 177.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 m -111.63 143.48 42.45 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.963 -0.754 . . . . 73.1 108.963 177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.2 p -142.88 121.09 12.22 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.572 0.349 . . . . 60.03 110.384 -178.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.406 HD11 HD21 ' A' ' 41' ' ' LEU . 71.1 mt -111.68 123.12 67.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 124.934 1.294 . . . . 63.55 109.767 -175.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.468 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 54.0 m -63.78 112.78 3.03 Favored 'General case' 0 C--N 1.359 1.022 0 CA-C-O 121.225 0.536 . . . . 55.14 111.097 -176.745 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.568 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.03 76.55 1.53 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.058 1.343 . . . . 55.03 108.318 -177.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.507 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 0.2 OUTLIER -57.89 -41.1 81.86 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 114.71 -1.132 . . . . 74.45 112.994 -177.151 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.418 ' OG1' ' HG2' ' A' ' 63' ' ' ARG . 9.9 m -105.36 159.96 15.5 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.29 0.636 . . . . 62.22 110.857 -168.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 19.1 ptpt -53.75 -50.59 65.67 Favored 'General case' 0 CA--C 1.554 1.129 0 N-CA-C 115.113 1.523 . . . . 75.03 115.113 -168.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -65.12 -39.8 93.59 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 118.406 0.548 . . . . 63.55 110.584 -175.551 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -64.32 -39.4 93.84 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.192 -0.913 . . . . 75.33 109.77 178.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.25 -30.5 71.55 Favored 'General case' 0 C--N 1.346 0.445 0 CA-C-N 115.028 -0.987 . . . . 74.42 111.904 179.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 32.3 mm-40 -82.46 -47.03 12.71 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 123.01 0.524 . . . . 73.13 111.389 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -74.05 -44.86 52.74 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.531 0.519 . . . . 73.12 111.334 -169.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.521 ' HD2' ' HB2' ' A' ' 62' ' ' ALA . 21.7 m-85 -71.42 -31.36 67.15 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.896 0.478 . . . . 74.45 110.577 -179.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.53 -55.28 25.16 Favored 'General case' 0 C--O 1.219 -0.51 0 O-C-N 123.891 0.744 . . . . 74.24 110.79 175.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 77' ' ' LYS . . . -57.02 -46.35 82.41 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.144 0.902 . . . . 61.35 111.527 -174.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -65.22 -39.29 84.96 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.234 0.614 . . . . 74.55 110.492 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 20.1 tp -72.06 -29.58 64.29 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.847 0.459 . . . . 71.22 111.216 -177.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.6 mp -67.56 -37.91 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.989 0 N-CA-C 108.475 -0.935 . . . . 54.54 108.475 172.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.435 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.6 mmmm -68.35 -36.01 78.59 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 123.247 0.342 . . . . 74.23 111.629 175.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 54.0 t -61.45 -40.84 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.929 0.891 . . . . 63.31 110.397 176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -74.02 -29.58 62.0 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-N 115.271 -0.877 . . . . 74.02 111.537 175.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.416 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -70.81 -27.36 63.83 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 123.029 0.532 . . . . 74.3 111.602 178.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.435 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 11.2 mm-40 -64.98 -40.04 94.38 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.513 0.725 . . . . 63.1 110.609 173.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 70.3 mt -104.98 -9.53 17.84 Favored 'General case' 0 N--CA 1.483 1.185 0 N-CA-C 113.108 0.781 . . . . 64.32 113.108 -166.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -143.01 -79.63 0.05 OUTLIER Glycine 0 C--N 1.344 1.024 0 C-N-CA 121.915 -0.183 . . . . 74.33 113.183 -174.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.416 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 26.3 t80 -160.88 155.17 23.13 Favored 'General case' 0 N--CA 1.479 1.025 0 N-CA-C 109.046 -0.724 . . . . 65.23 109.046 -170.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -70.96 -39.03 72.81 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 118.624 0.647 . . . . 74.12 112.157 -175.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -78.53 88.29 4.49 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.372 0.669 . . . . 73.54 109.769 -179.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 42.2 mm -112.84 148.25 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.322 0 C-N-CA 124.007 0.923 . . . . 73.53 110.053 -179.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.431 ' H ' ' HA ' ' A' ' 101' ' ' GLN . 27.1 t-20 -90.15 138.15 31.76 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.038 0.535 . . . . 70.21 110.536 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.28 131.16 60.87 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.725 0 C-N-CA 124.702 1.201 . . . . 71.12 108.668 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.3 m -125.99 132.65 51.99 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.182 0.993 . . . . 64.32 108.366 176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 24.6 t90 -136.73 105.66 5.93 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 107.442 -1.318 . . . . 73.24 107.442 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.557 ' HB3' ' HB2' ' A' ' 1' ' ' MET . 21.2 m-20 -106.27 -67.13 0.95 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.645 0.778 . . . . 53.0 110.071 -179.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -92.19 -147.74 21.3 Favored Glycine 0 C--N 1.344 1.017 0 CA-C-N 115.767 -0.651 . . . . 60.44 111.714 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -79.62 20.17 0.59 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.859 0.863 . . . . 72.45 111.611 179.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 96.5 m -144.98 135.31 24.15 Favored 'General case' 0 CA--C 1.556 1.2 0 C-N-CA 124.12 0.968 . . . . 75.14 109.843 -172.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.568 HG23 ' HB3' ' A' ' 62' ' ' ALA . 90.1 t -91.19 109.78 21.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 124.061 0.944 . . . . 64.44 109.21 178.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 61.4 m -95.75 129.7 42.89 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.485 1.114 . . . . 74.23 110.044 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.36 123.82 65.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 N-CA-C 107.739 -1.208 . . . . 63.53 107.739 178.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.43 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 41.1 tt0 -140.95 118.53 11.58 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.064 0.946 . . . . 72.25 109.054 -175.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 60.8 -113.23 5.36 Favored Glycine 0 C--N 1.348 1.228 0 O-C-N 123.844 0.715 . . . . 64.43 113.428 177.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.431 ' HA ' ' H ' ' A' ' 88' ' ' ASN . 18.7 pt20 -161.41 170.87 19.22 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.431 1.092 . . . . 53.35 109.965 179.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -55.55 133.22 50.18 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 124.007 0.817 . . . . 75.42 111.933 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -78.64 -34.16 46.69 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 123.362 0.665 . . . . 75.43 110.223 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 146.59 -71.05 0.34 Allowed Glycine 0 C--N 1.347 1.169 0 N-CA-C 110.98 -0.848 . . . . 70.45 110.98 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 48.6 t 49.94 78.69 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 125.045 1.338 . . . . 74.51 111.146 -177.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.051 0.941 . . . . 73.22 108.549 -177.973 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.5 ttm . . . . . 0 N--CA 1.479 0.992 0 N-CA-C 109.927 -0.397 . . . . 75.2 109.927 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t-80 62.39 45.28 6.65 Favored 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 124.546 1.138 . . . . 63.33 110.909 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -89.11 75.55 7.88 Favored 'General case' 0 N--CA 1.479 0.976 0 CA-C-O 122.375 1.083 . . . . 74.52 109.741 173.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -65.49 124.53 22.54 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 114.534 -1.212 . . . . 65.42 110.703 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 56.9 m80 -129.57 155.08 46.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.072 0.949 . . . . 75.41 110.089 176.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.1 t60 -72.83 99.27 2.61 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.671 0.789 . . . . 72.22 109.793 177.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -110.9 -28.94 8.14 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.427 -0.953 . . . . 70.23 108.427 166.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -117.41 167.83 10.91 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 124.958 1.303 . . . . 64.31 109.193 174.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 10.7 t -86.85 49.49 1.83 Allowed 'General case' 0 CA--C 1.555 1.155 0 CA-C-O 121.733 0.778 . . . . 54.2 110.173 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -90.72 48.8 3.08 Favored Glycine 0 C--N 1.352 1.43 0 CA-C-N 115.372 -0.831 . . . . 73.22 111.081 175.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.6 m-20 -87.8 129.49 35.17 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 123.961 0.904 . . . . 74.43 109.924 -174.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.443 HG21 HD22 ' A' ' 37' ' ' LEU . 50.5 mt -90.37 105.61 16.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 124.005 0.922 . . . . 53.34 110.148 -173.001 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.6 tt0 -98.23 121.25 39.93 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 109.719 -0.475 . . . . 74.02 109.719 174.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.0 t -92.09 131.86 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 N-CA-C 107.88 -1.156 . . . . 72.2 107.88 174.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -132.6 107.01 8.15 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 107.551 -1.278 . . . . 75.45 107.551 175.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.695 HD21 ' HB2' ' A' ' 56' ' ' SER . 4.4 t-20 -112.37 136.88 51.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.126 0.57 . . . . 74.42 109.591 -175.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -119.04 113.23 20.63 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.916 0.886 . . . . 74.03 109.95 -171.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.532 ' HB3' HD21 ' A' ' 21' ' ' ASN . 32.8 m-80 -126.3 129.49 48.97 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.119 0.968 . . . . 73.2 108.999 179.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.4 m -105.9 137.36 43.92 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 122.941 0.497 . . . . 72.53 109.813 179.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 49.8 t 62.41 76.66 0.36 Allowed 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.716 1.206 . . . . 71.12 111.065 179.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.532 HD21 ' HB3' ' A' ' 18' ' ' ASN . 9.6 m120 -113.92 -35.88 4.97 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.874 -1.057 . . . . 72.12 109.414 175.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 77.35 -69.2 2.57 Favored Glycine 0 C--N 1.354 1.549 0 N-CA-C 110.416 -1.074 . . . . 52.21 110.416 -171.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -83.83 80.96 8.97 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.513 1.125 . . . . 71.13 109.558 170.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.2 p -88.22 116.87 26.73 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.299 -0.864 . . . . 64.12 110.123 178.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -106.26 -169.83 1.63 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.69 0.796 . . . . 73.22 109.814 178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -65.06 107.45 1.53 Allowed 'General case' 0 N--CA 1.473 0.725 0 CA-C-O 121.25 0.548 . . . . 73.3 110.115 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.533 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 66.3 m-85 -102.44 -4.98 24.61 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.11 -0.95 . . . . 72.43 109.708 170.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 93.4 m -120.27 125.57 48.43 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.854 0.862 . . . . 72.24 109.471 177.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 83.3 m-85 -133.31 162.39 31.95 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.412 1.085 . . . . 73.04 109.183 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 31.9 m -130.61 106.78 8.72 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.014 -0.735 . . . . 53.43 109.014 173.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 25.0 m -114.26 134.72 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.073 0.949 . . . . 63.21 110.059 179.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.2 t -84.03 -18.87 35.63 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 123.113 0.565 . . . . 74.14 111.347 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.617 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 24.9 m -121.43 149.5 42.92 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 123.235 0.614 . . . . 75.2 111.606 -173.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -65.46 -37.06 85.74 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.594 1.558 . . . . 70.22 113.025 -176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 70.3 p -68.37 -35.9 78.4 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.163 0.585 . . . . 63.1 110.877 -179.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.617 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 20.5 mm-40 -65.37 -41.16 94.08 Favored 'General case' 0 C--N 1.346 0.444 0 CA-C-N 115.263 -0.881 . . . . 63.03 110.284 178.361 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.443 HD22 HG21 ' A' ' 12' ' ' ILE . 62.7 tp -55.05 -49.03 72.63 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.232 1.013 . . . . 64.33 111.957 176.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -59.81 -41.77 91.98 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.792 0.837 . . . . 72.44 111.643 -175.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.66 -39.97 80.41 Favored 'General case' 0 N--CA 1.477 0.883 0 CA-C-N 115.876 -0.602 . . . . 70.14 110.727 178.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 17.7 t -61.15 -46.54 96.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 C-N-CA 123.961 0.904 . . . . 73.3 110.911 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.6 mt -69.81 -31.54 69.49 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.501 0.72 . . . . 64.12 111.668 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -69.24 -39.46 78.5 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.141 0.576 . . . . 62.33 110.857 178.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -75.72 -43.18 48.28 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.154 0.502 . . . . 75.44 110.327 178.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 50.3 tp -58.05 -43.31 86.82 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 125.0 1.32 . . . . 73.23 110.647 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.441 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.3 ttpt -50.32 -46.16 55.32 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 125.121 1.369 . . . . 71.03 111.609 173.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 50' ' ' LYS . 30.2 t70 -65.38 -33.96 77.2 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.181 -0.918 . . . . 75.11 111.112 -178.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 74.7 m-85 -66.98 -48.72 67.6 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.028 0.531 . . . . 65.4 111.232 175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 64.6 mt -58.43 -41.81 82.57 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 123.684 0.793 . . . . 75.02 110.252 -178.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -70.11 -33.06 71.38 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 114.444 -1.253 . . . . 63.24 110.909 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -74.71 -46.31 38.43 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.317 0.647 . . . . 71.53 110.775 -172.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -148.4 143.89 27.11 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.825 0.45 . . . . 63.24 110.649 173.249 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.497 ' HA2' HD22 ' A' ' 21' ' ' ASN . . . 150.35 102.38 0.25 Allowed Glycine 0 C--N 1.341 0.849 0 N-CA-C 111.011 -0.836 . . . . 51.22 111.011 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.0 m -83.36 43.37 0.88 Allowed 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.663 0.785 . . . . 73.44 110.614 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -164.7 159.05 18.39 Favored 'General case' 0 C--O 1.245 0.857 0 C-N-CA 125.075 1.35 . . . . 70.11 108.677 -169.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.9 tpp85 -92.73 123.65 36.17 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 107.26 -1.385 . . . . 75.44 107.26 171.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.695 ' HB2' HD21 ' A' ' 16' ' ' ASN . 79.5 p -69.24 154.66 41.69 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.174 0.989 . . . . 74.14 112.534 -172.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.477 ' HG3' ' HB2' ' A' ' 99' ' ' GLU . 52.9 ttp180 -114.85 108.59 16.94 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.571 -0.9 . . . . 74.42 108.571 169.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.7 m -102.21 107.85 19.04 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.336 -0.987 . . . . 74.54 108.336 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.469 ' HB3' HG23 ' A' ' 97' ' ' THR . 32.1 p -107.62 118.73 37.51 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.954 0.902 . . . . 74.25 109.123 177.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.423 HD13 HD11 ' A' ' 37' ' ' LEU . 64.0 mt -111.67 141.06 28.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 C-N-CA 124.201 1.0 . . . . 74.21 109.318 -178.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.2 m -65.18 113.11 3.75 Favored 'General case' 0 CA--C 1.554 1.102 0 C-N-CA 123.465 0.706 . . . . 74.24 111.205 178.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -140.78 95.78 2.91 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.983 0.913 . . . . 72.43 109.81 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.42 -45.69 14.48 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.364 0.666 . . . . 73.21 110.209 -179.565 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.5 p -86.47 158.71 19.51 Favored 'General case' 0 C--O 1.246 0.906 0 C-N-CA 122.638 0.375 . . . . 55.05 110.352 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.3 ptpt -69.67 -31.79 70.05 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 122.924 0.49 . . . . 74.54 111.365 -176.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.403 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 71.0 mmtt -60.8 -46.92 88.63 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.67 0.388 . . . . 71.14 110.4 175.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 55.7 mt-10 -61.36 -40.73 95.39 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 124.25 0.969 . . . . 74.42 111.066 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.9 -34.72 76.57 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.196 0.598 . . . . 63.22 111.631 179.074 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 11.4 mm-40 -76.37 -52.44 9.89 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 123.453 0.701 . . . . 74.41 111.7 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.403 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 0.1 OUTLIER -71.31 -39.59 71.33 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.198 0.599 . . . . 74.45 112.262 -172.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 15.8 m-30 -71.78 -39.02 70.21 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 122.5 0.32 . . . . 51.41 110.17 -179.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.493 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.1 -44.95 96.57 Favored 'General case' 0 C--N 1.354 0.779 0 O-C-N 123.629 0.581 . . . . 75.43 110.404 176.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.02 -52.53 58.14 Favored 'General case' 0 N--CA 1.476 0.872 0 O-C-N 124.09 0.869 . . . . 74.2 111.062 179.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.8 mt -57.61 -43.91 84.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.857 0 CA-C-N 115.471 -0.786 . . . . 71.41 110.445 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.56 -27.29 65.94 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.252 0.621 . . . . 64.44 112.594 -179.126 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.412 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.4 mp -65.6 -45.27 92.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 108.999 -0.741 . . . . 72.41 108.999 173.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -36.2 77.28 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 112.129 0.418 . . . . 52.15 112.129 177.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.441 HG13 ' HB2' ' A' ' 45' ' ' LYS . 38.7 t -59.88 -52.13 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 C-N-CA 123.413 0.685 . . . . 62.25 109.884 177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.497 ' HB3' HD12 ' A' ' 87' ' ' ILE . 10.0 m-85 -71.77 -25.49 62.05 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.911 0.884 . . . . 74.15 112.214 -178.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -74.43 -27.43 60.61 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.745 0.418 . . . . 63.45 110.843 175.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -79.81 -23.99 41.69 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.222 0.609 . . . . 74.24 110.292 172.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 90.2 mt -79.65 -20.12 47.48 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.311 0.644 . . . . 73.35 110.405 171.396 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 169.69 126.5 0.86 Allowed Glycine 0 C--N 1.347 1.185 0 CA-C-O 119.218 -0.768 . . . . 74.45 111.579 175.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -66.07 95.09 0.26 Allowed 'General case' 0 C--N 1.359 0.997 0 CA-C-N 117.794 0.797 . . . . 65.44 109.429 179.672 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -147.51 161.04 41.9 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.511 -0.768 . . . . 74.42 109.374 -173.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -68.3 108.95 3.4 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 107.797 -1.186 . . . . 75.42 107.797 169.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.497 HD12 ' HB3' ' A' ' 79' ' ' TYR . 31.4 mm -88.16 133.26 31.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 C-N-CA 122.905 0.482 . . . . 74.52 110.233 -173.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.483 ' HA ' ' HB2' ' A' ' 102' ' ' LEU . 44.2 t30 -90.96 131.83 36.33 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.135 0.574 . . . . 74.15 111.212 -177.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 23.7 t -108.32 123.17 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 N-CA-C 108.061 -1.089 . . . . 74.12 108.061 171.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.7 m -121.94 109.82 15.09 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 107.9 -1.148 . . . . 63.34 107.9 174.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -78.07 150.73 33.71 Favored 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 109.486 -0.561 . . . . 74.12 109.486 177.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -142.19 162.54 35.22 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.363 1.465 . . . . 72.23 107.275 -175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -56.65 103.62 0.29 Allowed Glycine 0 CA--C 1.537 1.424 0 CA-C-N 118.021 0.373 . . . . 75.31 113.339 -177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 68.22 21.87 8.38 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.003 1.321 . . . . 71.24 112.095 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 49.4 m -146.96 127.3 13.95 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.718 0.807 . . . . 61.15 110.957 -175.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.493 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.2 p -92.85 117.3 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 N-CA-C 108.917 -0.771 . . . . 72.44 108.917 168.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.469 HG23 ' HB3' ' A' ' 59' ' ' SER . 33.4 m -114.28 106.08 13.92 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.382 0.673 . . . . 75.12 110.741 -171.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 39.4 t -98.44 116.66 41.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.733 0 C-N-CA 123.389 0.676 . . . . 72.42 109.971 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.477 ' HB2' ' HG3' ' A' ' 57' ' ' ARG . 36.3 tt0 -152.97 133.05 13.4 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.537 1.135 . . . . 61.53 109.607 178.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.6 -168.74 48.19 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 114.984 0.754 . . . . 70.05 114.984 168.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -97.74 135.2 39.87 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.011 0.925 . . . . 75.51 110.999 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.483 ' HB2' ' HA ' ' A' ' 88' ' ' ASN . 45.2 tp -82.72 104.67 13.14 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 108.037 -1.097 . . . . 64.45 108.037 168.317 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -68.79 150.07 48.26 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 122.886 0.474 . . . . 73.01 110.233 -179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -68.9 83.16 0.22 Allowed Glycine 0 C--N 1.349 1.303 0 O-C-N 123.495 0.497 . . . . 75.33 112.158 178.091 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 19.3 m -73.7 87.71 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.039 0 CA-C-O 122.052 0.929 . . . . 62.2 110.305 178.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.963 0 CA-C-N 114.786 -1.097 . . . . 74.35 110.753 -176.029 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.3 ttp . . . . . 0 N--CA 1.48 1.033 0 N-CA-C 110.475 -0.194 . . . . 64.01 110.475 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.1 m80 -133.9 114.67 13.55 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.221 1.008 . . . . 72.0 108.439 172.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -74.11 83.24 1.8 Allowed 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 121.123 0.487 . . . . 72.42 110.49 -178.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 58.9 t-80 -148.83 129.34 13.95 Favored 'General case' 0 C--O 1.237 0.437 0 N-CA-C 108.297 -1.001 . . . . 65.33 108.297 173.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.722 ' HB3' ' HB3' ' A' ' 8' ' ' ARG . 82.7 m-70 -85.8 112.69 21.32 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.263 -0.643 . . . . 74.04 109.263 -177.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -72.77 90.06 1.39 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.828 0.451 . . . . 64.32 110.065 178.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.6 t-80 57.95 30.55 19.33 Favored 'General case' 0 CA--C 1.558 1.266 0 C-N-CA 124.759 1.224 . . . . 53.13 111.613 174.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.722 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 8.1 tpm_? -92.31 107.73 19.43 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.689 0.796 . . . . 62.24 110.045 -176.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 35.0 t -128.65 176.65 7.62 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 124.066 0.946 . . . . 71.44 108.544 172.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.5 22.56 0.74 Allowed Glycine 0 C--N 1.337 0.631 0 N-CA-C 112.1 -0.4 . . . . 63.43 112.1 178.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -85.29 148.94 25.81 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.686 0.394 . . . . 75.43 110.337 -179.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.576 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.6 mt -80.86 102.98 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 CA-C-N 115.56 -0.745 . . . . 63.32 109.526 -174.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -88.44 111.62 21.99 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.826 -0.805 . . . . 70.35 108.826 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 11.5 t -101.41 108.82 24.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.219 1.007 . . . . 73.13 108.688 -179.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.491 ' HA ' ' O ' ' A' ' 27' ' ' TYR . 36.6 tt0 -131.99 122.14 25.05 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 118.005 0.366 . . . . 74.43 110.398 -177.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.417 HD21 ' HB2' ' A' ' 56' ' ' SER . 27.6 t-20 -104.95 124.99 50.47 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.091 0.956 . . . . 54.33 108.56 174.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.8 OUTLIER -103.78 128.54 51.18 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.827 1.251 . . . . 71.34 108.307 -179.138 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 p30 -100.75 116.42 32.61 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 120.945 0.402 . . . . 75.45 110.062 -176.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.43 ' O ' ' HB3' ' A' ' 54' ' ' LYS . 74.2 p -96.54 110.17 22.61 Favored 'General case' 0 C--N 1.349 0.563 0 N-CA-C 108.214 -1.032 . . . . 63.04 108.214 172.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 53.8 t 173.23 149.83 0.07 Allowed 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.869 1.668 . . . . 71.24 107.687 -176.181 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -84.73 68.9 10.59 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.817 0.818 . . . . 73.24 109.224 177.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -155.41 119.32 0.91 Allowed Glycine 0 C--N 1.345 1.04 0 N-CA-C 109.734 -1.346 . . . . 43.35 109.734 -179.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -73.71 85.74 1.65 Allowed 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 121.663 0.744 . . . . 73.5 111.227 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 4.2 t -122.23 139.18 54.08 Favored 'General case' 0 C--O 1.241 0.65 0 N-CA-C 107.949 -1.13 . . . . 72.03 107.949 170.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 22.8 p90 -62.33 134.94 57.18 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.324 0.65 . . . . 74.03 111.322 -175.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -74.17 108.34 6.91 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.124 -1.065 . . . . 73.4 108.124 174.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.491 ' O ' ' HA ' ' A' ' 15' ' ' GLN . 60.2 m-85 -58.27 110.36 0.94 Allowed 'General case' 0 N--CA 1.475 0.78 0 O-C-N 124.417 1.073 . . . . 75.11 111.18 -170.588 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 26.5 m -118.62 124.31 47.11 Favored 'General case' 0 N--CA 1.471 0.582 0 CA-C-O 121.212 0.529 . . . . 63.25 109.899 178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.5 m-85 -133.72 150.96 51.51 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 125.042 1.337 . . . . 71.21 107.589 177.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 59.6 m -130.13 105.42 7.92 Favored 'General case' 0 C--O 1.237 0.417 0 N-CA-C 108.016 -1.105 . . . . 74.51 108.016 170.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 24.2 m -104.86 148.64 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 123.947 0.899 . . . . 75.54 109.171 179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.8 t -101.55 -21.22 14.78 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 120.909 0.385 . . . . 61.43 110.556 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.562 ' HB ' ' HG3' ' A' ' 36' ' ' GLU . 18.7 m -107.8 143.61 36.12 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.845 0.858 . . . . 73.42 110.138 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -73.49 -25.59 60.52 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.971 0.908 . . . . 74.41 111.129 -179.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.465 ' H ' HG22 ' A' ' 33' ' ' THR . 19.3 m -63.04 -40.15 96.85 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 122.984 0.514 . . . . 71.1 110.147 172.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.562 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 51.8 mt-10 -63.42 -45.85 89.06 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.4 -0.818 . . . . 61.13 109.967 176.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.499 HD21 HD13 ' A' ' 60' ' ' ILE . 2.7 tm? -51.94 -47.6 64.67 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 123.709 0.804 . . . . 71.33 110.793 176.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -60.67 -46.66 89.52 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.176 0.99 . . . . 73.4 111.591 -175.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -80.59 -25.52 38.45 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 116.233 -0.439 . . . . 75.1 111.825 -176.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.1 t -66.32 -50.29 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 N-CA-C 109.618 -0.512 . . . . 73.43 109.618 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.488 HD21 HD11 ' A' ' 60' ' ' ILE . 76.2 mt -61.54 -38.46 87.51 Favored 'General case' 0 N--CA 1.485 1.306 0 O-C-N 123.701 0.626 . . . . 71.23 112.049 179.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 10.7 t30 -66.5 -40.21 89.12 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.361 0.664 . . . . 54.51 110.647 -179.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -73.34 -42.9 61.73 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-O 121.348 0.594 . . . . 75.24 109.873 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.414 ' O ' HG13 ' A' ' 48' ' ' ILE . 37.6 tp -63.52 -34.27 77.41 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 125.339 1.455 . . . . 72.12 110.913 -175.49 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -53.43 -39.66 64.55 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 125.122 1.369 . . . . 62.34 112.313 -178.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -60.97 -47.1 87.99 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.655 0.782 . . . . 71.14 110.733 175.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.422 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 97.0 m-85 -70.48 -32.97 70.71 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-N 115.18 -0.918 . . . . 62.22 112.172 -176.406 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 44' ' ' LEU . 86.3 mt -66.71 -44.2 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.722 0.809 . . . . 61.24 109.424 177.179 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.6 ttmt -63.52 -38.37 90.86 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.885 0.874 . . . . 74.01 110.233 177.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 34.8 ttmt -72.39 -23.16 61.07 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.645 -1.161 . . . . 73.12 111.668 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.422 ' HG2' ' O ' ' A' ' 47' ' ' TYR . 3.9 pt20 -114.83 16.86 17.26 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.633 0.773 . . . . 74.22 110.432 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.4 46.32 3.53 Favored Glycine 0 C--N 1.347 1.147 0 C-N-CA 123.11 0.386 . . . . 11.24 113.244 -176.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 56.2 m -64.3 -36.22 83.39 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.995 0.918 . . . . 73.34 110.307 175.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.43 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.8 ttmp? -127.29 -96.46 0.42 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.181 -0.918 . . . . 51.34 109.207 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.3 mpt_? -142.77 169.29 17.84 Favored 'General case' 0 N--CA 1.492 1.659 0 CA-C-N 118.791 0.723 . . . . 75.0 110.927 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.417 ' HB2' HD21 ' A' ' 16' ' ' ASN . 80.6 p -137.81 155.42 49.03 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 124.435 1.094 . . . . 74.23 109.517 175.661 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.8 ttm180 -132.21 107.98 8.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.192 0.597 . . . . 52.12 109.892 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.606 ' HB ' HD21 ' A' ' 75' ' ' LEU . 28.2 m -98.8 117.95 34.44 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-O 120.749 0.309 . . . . 55.23 110.329 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.2 p -103.89 121.44 43.1 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.685 1.194 . . . . 75.44 109.537 172.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.499 HD13 HD21 ' A' ' 37' ' ' LEU . 86.4 mt -124.9 131.08 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.037 0 C-N-CA 124.981 1.312 . . . . 74.4 108.671 -179.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.576 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 46.7 m -61.75 113.2 2.61 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 120.914 0.388 . . . . 72.52 110.487 177.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.52 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -125.46 94.52 4.17 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 125.469 1.508 . . . . 65.32 107.739 -178.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 14.9 mtm180 -76.6 -66.32 0.82 Allowed 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 115.823 -0.626 . . . . 73.02 110.413 -166.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 28.7 p -93.83 -176.53 4.07 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 115.608 -0.724 . . . . 70.55 109.905 -179.198 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 51.2 mtmt -63.31 -37.11 85.99 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.183 0.593 . . . . 73.44 110.652 175.155 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -53.42 -54.24 39.75 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 124.158 0.983 . . . . 71.41 110.925 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.52 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 2.2 mp0 -63.22 -38.94 93.16 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-N 115.448 -0.796 . . . . 62.43 110.691 177.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.08 -23.82 66.59 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.505 0.722 . . . . 70.23 112.526 179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 42.7 mm-40 -79.43 -60.56 2.31 Favored 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 109.787 -0.449 . . . . 62.51 109.787 176.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.1 ptmm? -79.64 -41.69 26.44 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.193 -0.912 . . . . 73.01 113.177 -164.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.5 m-30 -69.92 -41.57 74.48 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-O 120.727 0.298 . . . . 72.41 110.226 -179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.418 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -66.22 -37.52 85.74 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.042 -0.981 . . . . 64.13 111.115 176.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.36 -53.0 61.4 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.35 0.26 . . . . 71.45 110.707 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.0 mt -60.23 -38.81 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.056 0 O-C-N 123.989 0.805 . . . . 54.23 110.45 179.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.606 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.5 tt -62.78 -48.19 80.21 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 123.944 0.898 . . . . 72.53 110.454 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.418 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.7 mp -62.54 -37.77 79.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.591 0.757 . . . . 72.51 110.251 178.434 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.2 mtpt -66.96 -41.5 86.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 122.884 0.474 . . . . 74.23 111.022 179.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.525 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 26.9 t -53.05 -53.31 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.075 0 C-N-CA 123.773 0.829 . . . . 73.04 109.646 175.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -67.97 -30.33 69.59 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.073 -0.967 . . . . 65.3 112.312 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.53 65.94 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.066 0.546 . . . . 41.53 111.094 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.5 mt-10 -78.85 -32.16 45.92 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.495 -0.775 . . . . 74.43 110.546 174.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.525 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 66.0 mt -75.42 -27.73 59.1 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.296 0.638 . . . . 40.34 110.986 178.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.13 113.73 0.58 Allowed Glycine 0 C--N 1.335 0.516 0 N-CA-C 109.444 -1.463 . . . . 71.41 109.444 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -78.58 74.33 5.11 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 123.695 0.798 . . . . 73.42 110.53 -169.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -147.11 178.33 8.46 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.144 1.377 . . . . 75.2 108.66 -179.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.0 m-20 -75.76 134.53 40.43 Favored 'General case' 0 N--CA 1.481 1.102 0 N-CA-C 108.72 -0.845 . . . . 72.32 108.72 172.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 36.8 mm -107.01 147.44 12.27 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 123.13 0.572 . . . . 72.53 110.094 -173.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 44.6 t30 -86.37 139.06 31.3 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.522 0.729 . . . . 71.42 110.529 -171.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 19.6 t -115.62 125.82 72.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 109.182 -0.673 . . . . 54.34 109.182 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.3 m -130.2 135.22 47.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 107.999 -1.111 . . . . 72.32 107.999 170.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.6 t90 -136.82 119.92 16.59 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.658 -0.497 . . . . 74.23 109.658 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -70.93 -35.33 72.19 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.926 0.89 . . . . 53.53 111.047 178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 126.31 -20.77 6.18 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 115.793 -0.64 . . . . 73.14 111.771 -173.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -124.06 -21.96 4.93 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 124.004 0.922 . . . . 74.21 110.165 176.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 88.8 m -144.89 132.22 20.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.796 0.838 . . . . 74.21 110.088 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.92 125.56 45.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.012 0 C-N-CA 123.662 0.785 . . . . 73.51 109.972 173.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 4.6 m -118.16 132.03 56.36 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.269 1.027 . . . . 52.3 109.194 -178.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 52.9 t -133.84 122.08 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.299 0.64 . . . . 51.23 110.867 -175.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -148.19 147.63 29.64 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 124.299 1.04 . . . . 65.2 108.688 168.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 76.5 -164.13 53.18 Favored Glycine 0 C--N 1.343 0.949 0 O-C-N 123.603 0.564 . . . . 43.2 112.975 176.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -111.94 155.76 23.19 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 123.425 0.69 . . . . 71.13 110.155 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 51.4 tp -73.46 102.55 3.83 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 108.102 -1.073 . . . . 72.04 108.102 173.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.9 tt0 -85.83 89.9 7.9 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 115.02 -0.991 . . . . 72.42 109.0 -179.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 70.06 -106.83 1.94 Allowed Glycine 0 C--N 1.345 1.071 0 CA-C-N 115.514 -0.766 . . . . 45.04 111.313 -174.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 14.9 p -143.73 156.7 16.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.861 0 C-N-CA 124.222 1.009 . . . . 62.41 109.209 -179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 C--O 1.253 1.268 0 C-N-CA 123.358 0.663 . . . . 61.23 109.255 173.22 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.405 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 110.351 -0.24 . . . . 64.11 110.351 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -80.42 -25.39 39.04 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.604 0.362 . . . . 74.33 110.412 177.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -74.08 81.49 1.75 Allowed 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 107.909 -1.145 . . . . 65.53 107.909 173.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 30.7 t60 -92.93 106.64 18.57 Favored 'General case' 0 C--O 1.238 0.472 0 N-CA-C 108.023 -1.103 . . . . 63.45 108.023 -179.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.0 p-80 -61.99 132.39 52.77 Favored 'General case' 0 C--O 1.244 0.775 0 O-C-N 123.458 0.474 . . . . 74.25 110.172 179.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -86.9 89.03 7.84 Favored 'General case' 0 C--O 1.24 0.563 0 N-CA-C 109.046 -0.724 . . . . 73.14 109.046 -177.492 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.6 p80 -70.32 89.5 0.67 Allowed 'General case' 0 CA--C 1.549 0.93 0 N-CA-C 108.836 -0.802 . . . . 74.11 108.836 177.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 32.4 ttt-85 -74.19 79.97 1.79 Allowed 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 121.798 0.808 . . . . 72.43 109.086 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 36.4 t -164.84 169.6 16.44 Favored 'General case' 0 C--O 1.252 1.199 0 CA-C-N 114.432 -1.258 . . . . 65.04 108.353 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.438 ' HA3' ' NE ' ' A' ' 63' ' ' ARG . . . 171.52 60.99 0.04 OUTLIER Glycine 0 CA--C 1.502 -0.728 0 CA-C-N 115.505 -0.77 . . . . 54.3 111.196 -179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -63.43 143.78 57.52 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 123.314 0.646 . . . . 74.4 109.969 176.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 37.2 mt -73.79 102.57 1.89 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 CA-C-N 115.731 -0.668 . . . . 54.52 109.626 -172.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -94.38 111.8 23.56 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 108.768 -0.827 . . . . 53.43 108.768 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 36.6 t -104.7 127.86 58.8 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 C-N-CA 124.3 1.04 . . . . 73.25 109.534 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.442 ' HG2' HG23 ' A' ' 28' ' ' THR . 24.2 mt-30 -128.24 150.99 49.8 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.486 -0.931 . . . . 73.25 108.486 173.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.68 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 29.6 t-20 -130.42 118.65 21.5 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.514 -1.291 . . . . 73.41 107.514 172.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -102.37 110.86 22.93 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.078 0.951 . . . . 71.45 108.577 -174.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 20' ' ' CYS . 23.4 p-10 -146.72 159.08 43.93 Favored 'General case' 0 C--O 1.239 0.52 0 C-N-CA 125.158 1.383 . . . . 74.14 109.902 -179.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.44 ' H ' ' HD2' ' A' ' 54' ' ' LYS . 33.2 m -95.41 110.27 22.33 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 107.281 -1.377 . . . . 72.34 107.281 163.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.561 ' HG ' HG23 ' A' ' 24' ' ' THR . 44.0 t -109.16 112.11 24.09 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 123.226 0.61 . . . . 72.51 109.539 -176.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 46.8 m-20 -75.89 82.2 2.8 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.04 0.936 . . . . 72.22 109.449 177.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 176.67 -151.06 10.89 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 115.405 -0.816 . . . . 74.41 111.713 -176.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -105.02 -26.27 12.21 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.088 0.555 . . . . 72.41 110.523 177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.561 HG23 ' HG ' ' A' ' 20' ' ' CYS . 5.2 t -71.29 111.99 7.06 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-O 121.232 0.539 . . . . 63.21 109.601 175.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -146.07 3.83 0.94 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.62 0.768 . . . . 75.3 109.455 178.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -94.71 52.3 1.49 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.549 1.54 . . . . 74.21 109.916 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.68 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 23.3 m-85 -80.14 50.86 1.29 Allowed 'General case' 0 CA--C 1.558 1.271 0 C-N-CA 124.173 0.989 . . . . 74.51 110.895 179.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.442 HG23 ' HG2' ' A' ' 15' ' ' GLN . 85.8 m -136.4 119.72 16.8 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.39 0.676 . . . . 72.34 109.41 -177.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -123.95 153.03 41.81 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.596 1.159 . . . . 71.23 108.005 176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 76.7 m -130.42 106.24 8.41 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.17 -1.048 . . . . 54.25 108.17 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.453 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 17.8 m -104.22 146.69 11.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.816 0 C-N-CA 123.587 0.755 . . . . 74.02 110.091 -178.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.0 t -95.06 -22.66 17.76 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.864 0.465 . . . . 63.31 111.527 -176.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 11.6 t -133.92 164.16 27.91 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-O 121.036 0.446 . . . . 60.43 111.312 -178.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -70.36 -28.81 65.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.148 0.979 . . . . 75.15 112.656 -177.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 m -57.79 -36.78 72.65 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 123.608 0.568 . . . . 74.43 111.135 178.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.453 ' HB2' ' HB ' ' A' ' 31' ' ' VAL . 39.9 mt-10 -75.14 -53.27 9.13 Favored 'General case' 0 CA--C 1.536 0.404 0 CA-C-N 114.896 -1.047 . . . . 74.52 109.921 176.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 68.1 tp -49.65 -44.9 47.98 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.943 0.897 . . . . 71.23 111.982 -177.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -52.24 -56.9 11.71 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.862 1.265 . . . . 71.24 111.624 178.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 15.7 pttp -71.99 -33.76 68.36 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 116.429 -0.35 . . . . 65.41 111.267 -177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 t -65.34 -39.24 84.69 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 C-N-CA 124.638 1.175 . . . . 75.34 111.415 -175.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.556 ' HB3' HG21 ' A' ' 78' ' ' VAL . 87.8 mt -71.57 -31.84 67.42 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.954 0.502 . . . . 74.13 111.176 177.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -69.94 -35.59 74.64 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.872 0.869 . . . . 73.23 110.62 175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.42 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 48.4 mt-10 -77.22 -37.76 52.65 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.648 0.779 . . . . 71.01 110.351 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.441 HD21 ' HB2' ' A' ' 16' ' ' ASN . 43.2 tp -67.04 -35.72 80.5 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.827 0.851 . . . . 75.11 109.577 179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.13 -33.83 58.81 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 125.309 1.444 . . . . 73.35 111.967 175.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -62.27 -52.44 63.71 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.516 0.727 . . . . 63.52 110.929 175.192 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 85.2 m-85 -64.88 -39.51 93.66 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 122.883 0.473 . . . . 75.42 111.621 -175.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 65.4 mt -68.45 -41.52 83.34 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 123.692 0.797 . . . . 72.33 110.4 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -70.0 -35.53 74.45 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.349 0.659 . . . . 73.23 110.928 -179.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -64.43 -40.72 96.29 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 114.872 -1.058 . . . . 74.41 111.083 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.413 HE22 ' ND2' ' A' ' 18' ' ' ASN . 10.5 pt20 -83.37 155.48 23.5 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.377 -0.829 . . . . 73.23 110.594 176.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -153.36 27.52 0.78 Allowed Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.412 -0.813 . . . . 54.22 111.218 175.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 12.1 p -72.03 -44.05 64.01 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.764 0.826 . . . . 62.22 108.998 174.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.44 ' HD2' ' H ' ' A' ' 19' ' ' THR . 18.5 ptpt -154.89 -169.11 3.1 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 114.932 -1.031 . . . . 72.21 110.002 174.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.9 ttp180 -97.04 142.88 28.44 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.777 1.231 . . . . 64.13 109.469 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 15.9 m -107.85 149.2 28.55 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.531 0.733 . . . . 71.24 110.24 -179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 4.5 ptp180 -118.28 139.45 51.3 Favored 'General case' 0 N--CA 1.486 1.366 0 N-CA-C 109.465 -0.568 . . . . 71.44 109.465 173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.454 ' HB ' HD21 ' A' ' 75' ' ' LEU . 33.1 m -117.34 122.02 42.74 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 118.047 0.385 . . . . 74.4 110.385 179.599 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 35.0 p -102.38 128.12 49.1 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.334 1.054 . . . . 65.14 110.382 176.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.474 HG21 ' HB3' ' A' ' 71' ' ' PHE . 65.5 mt -123.45 138.7 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 124.351 1.061 . . . . 63.15 108.932 178.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 61.9 m -59.8 107.25 0.58 Allowed 'General case' 0 CA--C 1.55 0.949 0 CA-C-O 121.054 0.454 . . . . 52.32 111.243 176.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.57 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -122.42 52.31 1.32 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 125.347 1.459 . . . . 71.5 108.613 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 2.5 ptm180 -46.75 -32.37 3.58 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 126.352 1.861 . . . . 73.42 114.468 -176.452 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 67.5 p -120.22 171.37 8.54 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.68 0.392 . . . . 74.01 111.224 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -61.09 -37.81 84.04 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.46 1.104 . . . . 65.35 112.058 177.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.4 tptt -75.67 -41.51 53.76 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.246 0.619 . . . . 74.33 110.06 -176.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 43.7 mt-10 -68.38 -25.99 65.34 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.301 -0.863 . . . . 74.55 111.191 176.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.57 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -65.93 -36.69 84.07 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.458 0.703 . . . . 71.15 111.728 173.379 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.0 mm-40 -75.89 -54.51 6.78 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 122.764 0.426 . . . . 71.12 111.706 -178.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.1 OUTLIER -67.35 -44.69 78.41 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 123.421 0.689 . . . . 74.33 112.782 -171.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.474 ' HB3' HG21 ' A' ' 60' ' ' ILE . 22.9 m-30 -75.12 -34.81 61.72 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 122.587 0.355 . . . . 75.13 111.623 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -69.11 -40.38 78.38 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.831 -0.622 . . . . 44.11 111.015 177.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.08 -40.77 70.74 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 112.823 0.675 . . . . 73.33 112.823 -175.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 46.4 mt -64.54 -38.99 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.694 0.797 . . . . 64.25 109.619 176.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 41' ' ' LEU . 24.4 tp -77.08 -22.24 53.13 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 124.305 1.042 . . . . 75.32 111.687 -179.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.546 HG13 HG21 ' A' ' 87' ' ' ILE . 1.4 mp -69.89 -41.12 79.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.227 0 N-CA-C 108.328 -0.99 . . . . 74.12 108.328 173.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -59.05 -43.42 91.67 Favored 'General case' 0 C--N 1.359 0.982 0 O-C-N 123.926 0.766 . . . . 61.23 110.82 174.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.556 HG21 ' HB3' ' A' ' 41' ' ' LEU . 68.9 t -56.16 -56.92 10.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.148 0.979 . . . . 73.21 111.134 178.052 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -69.63 -23.74 63.54 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 123.521 0.729 . . . . 73.3 112.358 -176.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -67.6 -38.84 84.55 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.759 0.423 . . . . 64.31 110.657 172.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -76.38 -27.83 56.52 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.267 0.627 . . . . 63.03 111.32 177.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 95.6 mt -76.54 -27.28 55.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.173 0.589 . . . . 75.24 111.649 178.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 161.8 84.08 0.05 OUTLIER Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.797 -0.921 . . . . 35.55 110.797 177.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -69.98 98.48 1.29 Allowed 'General case' 0 CA--C 1.543 0.674 0 CA-C-O 121.155 0.502 . . . . 75.5 110.562 -179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -120.51 -67.25 0.99 Allowed 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 106.873 -1.528 . . . . 73.12 106.873 169.213 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -153.18 150.53 29.13 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 108.058 -1.09 . . . . 65.11 108.058 172.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.546 HG21 HG13 ' A' ' 76' ' ' ILE . 35.5 mm -116.49 110.67 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.562 -0.532 . . . . 70.25 109.562 -174.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -88.61 107.72 19.06 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.773 -0.825 . . . . 72.21 108.773 177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -100.8 107.56 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 N-CA-C 108.626 -0.879 . . . . 72.41 108.626 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m -94.85 106.24 18.21 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.747 -0.834 . . . . 75.44 108.747 176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.3 t90 -91.15 107.02 18.92 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 107.818 -1.178 . . . . 73.4 107.818 177.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -69.72 -17.96 63.5 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.5 1.12 . . . . 75.41 111.505 175.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 112.51 -47.77 1.01 Allowed Glycine 0 C--N 1.349 1.272 0 N-CA-C 110.803 -0.919 . . . . 74.13 110.803 -176.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.672 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 8.6 p-10 -104.18 -7.33 20.21 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.594 1.158 . . . . 75.21 110.453 177.112 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.43 ' HA ' ' H ' ' A' ' 62' ' ' ALA . 91.0 m -146.9 146.07 30.03 Favored 'General case' 0 CA--C 1.553 1.091 0 C-N-CA 123.595 0.758 . . . . 73.23 111.143 -176.179 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 62' ' ' ALA . 3.6 m -107.88 108.45 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.487 0.715 . . . . 52.53 109.527 164.636 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 45.9 m -94.35 102.98 14.99 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.4 -0.963 . . . . 72.22 108.4 171.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 79.1 t -93.4 131.19 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.471 0 N-CA-C 109.11 -0.7 . . . . 64.13 109.11 177.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -150.75 158.15 43.81 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.408 1.083 . . . . 75.32 108.665 -177.499 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -83.16 169.36 47.89 Favored Glycine 0 CA--C 1.531 1.035 0 N-CA-C 111.698 -0.561 . . . . 73.34 111.698 170.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.402 ' H ' ' CD ' ' A' ' 101' ' ' GLN . 0.0 OUTLIER -81.84 146.85 29.66 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.669 0.788 . . . . 73.21 110.181 178.876 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -76.58 159.6 30.17 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-N 115.64 -0.709 . . . . 74.32 109.497 172.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.87 -25.06 68.11 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.496 0.718 . . . . 63.42 110.96 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 82.35 143.89 4.74 Favored Glycine 0 C--N 1.351 1.404 0 CA-C-N 115.808 -0.633 . . . . 54.45 112.782 171.449 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 42.9 t -74.38 87.15 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.644 0 N-CA-C 108.723 -0.843 . . . . 63.41 108.723 177.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.4 t70 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 123.989 0.916 . . . . 72.41 109.681 -178.609 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.5 ppp? . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 119.76 -0.162 . . . . 63.52 111.39 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.2 t-80 -73.28 85.3 1.42 Allowed 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 123.318 0.647 . . . . 64.15 110.488 -178.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 p80 -158.68 128.58 5.82 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.648 -0.705 . . . . 71.31 109.975 174.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.5 m-70 -141.85 170.38 15.83 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.734 1.213 . . . . 71.21 108.711 176.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.2 t-80 -74.38 111.38 9.5 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 109.601 -0.518 . . . . 72.51 109.601 177.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 82.9 m-70 -79.41 149.97 31.46 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 123.62 0.768 . . . . 73.11 110.157 -179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -86.58 53.53 2.84 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.115 0.966 . . . . 71.41 108.881 176.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 50.6 ttp180 55.54 80.57 0.13 Allowed 'General case' 0 C--N 1.359 1.012 0 C-N-CA 124.453 1.101 . . . . 73.3 109.962 -176.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 42.7 m -56.1 116.41 3.0 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.612 0.765 . . . . 74.44 111.809 -172.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -74.22 83.57 0.74 Allowed Glycine 0 C--N 1.346 1.089 0 N-CA-C 110.083 -1.207 . . . . 53.12 110.083 171.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.5 m-20 -60.93 129.2 40.26 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.671 0.788 . . . . 62.45 111.987 -172.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.45 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 31.2 mt -73.48 105.47 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 CA-C-N 114.609 -1.178 . . . . 73.24 109.398 -175.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -80.57 128.55 33.74 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 109.47 -0.567 . . . . 60.04 109.47 177.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.8 t -111.0 108.89 26.6 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 C-N-CA 125.038 1.335 . . . . 71.43 108.05 179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -123.54 108.59 12.8 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.387 0.539 . . . . 74.21 110.182 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 18.1 t-20 -104.75 115.28 30.04 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 108.22 -1.03 . . . . 72.31 108.22 172.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -102.03 111.35 23.59 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.505 -0.924 . . . . 61.34 108.505 178.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -100.26 127.78 46.47 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.448 -0.945 . . . . 62.1 108.448 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.47 ' HB ' ' HE3' ' A' ' 54' ' ' LYS . 67.1 p -96.94 117.19 30.6 Favored 'General case' 0 C--O 1.243 0.743 0 N-CA-C 108.893 -0.78 . . . . 63.31 108.893 178.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 36.1 t -160.19 -169.36 2.46 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 124.313 1.045 . . . . 75.2 108.642 -172.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -70.61 159.81 33.69 Favored 'General case' 0 C--O 1.245 0.817 0 N-CA-C 109.135 -0.691 . . . . 75.4 109.135 168.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.66 -149.95 0.28 Allowed Glycine 0 C--N 1.346 1.09 0 CA-C-O 119.921 -0.377 . . . . 51.32 112.249 172.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm 65.6 5.5 3.32 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 123.675 0.79 . . . . 74.15 111.824 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.482 HG21 HE22 ' A' ' 51' ' ' GLN . 39.4 p -132.23 177.73 7.35 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 124.623 1.169 . . . . 73.5 109.754 -170.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -118.31 164.01 15.84 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.914 0.486 . . . . 74.21 111.056 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -112.64 160.87 17.45 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.147 -0.933 . . . . 75.5 109.723 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.492 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 80.6 m-85 -102.49 116.92 33.61 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.625 0.37 . . . . 63.23 111.814 -169.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 m -139.84 121.61 15.43 Favored 'General case' 0 N--CA 1.471 0.591 0 N-CA-C 108.787 -0.82 . . . . 64.2 108.787 167.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 78.5 m-85 -127.36 160.07 32.49 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.119 1.368 . . . . 73.51 108.219 176.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.6 m -130.89 126.04 35.12 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.077 -0.712 . . . . 74.4 109.077 175.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.536 HG21 ' HB2' ' A' ' 37' ' ' LEU . 34.0 m -120.64 173.15 6.73 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.932 0.893 . . . . 73.51 109.007 174.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.0 t -131.59 -3.49 3.75 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.654 0.782 . . . . 75.33 110.574 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.426 HG22 ' H ' ' A' ' 35' ' ' SER . 33.4 m -141.05 149.1 41.24 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.699 0.799 . . . . 45.31 109.638 -178.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -63.49 -35.57 80.88 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 124.41 1.084 . . . . 70.45 111.378 -178.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.426 ' H ' HG22 ' A' ' 33' ' ' THR . 9.3 m -60.91 -40.5 93.37 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 124.068 0.947 . . . . 75.3 111.177 179.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 56.9 mt-10 -71.3 -41.8 69.47 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.806 0.842 . . . . 60.13 110.084 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.536 ' HB2' HG21 ' A' ' 31' ' ' VAL . 65.4 tp -57.55 -42.75 83.59 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 124.294 0.996 . . . . 72.31 111.002 176.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -59.44 -45.61 91.09 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 124.22 0.95 . . . . 74.54 110.266 178.187 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -63.67 -34.62 78.26 Favored 'General case' 0 N--CA 1.475 0.797 0 CA-C-N 115.647 -0.706 . . . . 74.14 111.132 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 78.3 t -70.57 -46.25 70.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.784 0 C-N-CA 123.374 0.67 . . . . 74.24 110.388 177.389 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 45' ' ' LYS . 53.9 mt -69.45 -45.65 68.57 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 122.779 0.432 . . . . 63.42 111.938 -170.21 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -64.11 -30.11 71.2 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 123.444 0.465 . . . . 51.22 111.587 179.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -81.73 -55.96 4.3 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.79 0.836 . . . . 71.43 109.49 -176.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.455 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -67.65 -22.15 65.32 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.466 1.107 . . . . 63.22 111.093 -175.181 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.43 ' HB2' ' O ' ' A' ' 41' ' ' LEU . 38.6 ttpt -46.12 -49.96 16.0 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.577 1.551 . . . . 61.11 112.974 175.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -65.77 -31.42 72.39 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 115.273 -0.876 . . . . 64.34 110.622 -178.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -79.55 -29.03 41.23 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.521 1.129 . . . . 55.42 111.036 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.455 HG13 ' O ' ' A' ' 44' ' ' LEU . 73.7 mt -63.52 -47.97 89.11 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 N-CA-C 108.762 -0.829 . . . . 74.4 108.762 175.461 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.589 ' HB2' HD22 ' A' ' 82' ' ' LEU . 34.3 ttpt -54.41 -49.49 69.8 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 114.354 -1.294 . . . . 74.55 111.401 176.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.49 -36.16 81.64 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.525 1.13 . . . . 73.11 111.931 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.482 HE22 HG21 ' A' ' 24' ' ' THR . 17.3 mm100 -106.35 -7.53 17.65 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.353 0.661 . . . . 73.14 112.726 -175.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -90.76 68.98 2.26 Favored Glycine 0 N--CA 1.468 0.796 0 N-CA-C 111.237 -0.745 . . . . 75.33 111.237 -179.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 49.3 t -72.55 -38.19 68.05 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.19 0.596 . . . . 63.14 111.7 -174.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.47 ' HE3' ' HB ' ' A' ' 19' ' ' THR . 55.6 mtmt -102.21 -63.53 1.15 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.391 0.676 . . . . 50.31 109.704 178.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 15.2 ptp180 -153.57 167.21 30.28 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.514 0.726 . . . . 71.44 109.972 178.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 80.9 p -134.25 140.35 46.38 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 109.064 -0.717 . . . . 41.22 109.064 172.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.9 tmm_? -125.37 108.97 12.21 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.278 -1.379 . . . . 63.22 107.278 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.433 ' HB ' HD21 ' A' ' 75' ' ' LEU . 5.5 m -103.28 139.62 38.48 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.312 -0.625 . . . . 70.12 109.312 177.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.0 m -133.94 122.35 22.97 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 124.547 1.139 . . . . 74.33 108.792 -176.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 73.2 mt -120.83 137.04 55.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.226 1.011 . . . . 72.2 108.756 -178.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.45 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 63.6 m -67.18 120.25 13.43 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 122.792 0.437 . . . . 73.33 111.187 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -148.68 99.1 2.96 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.484 1.114 . . . . 75.23 108.961 -179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.07 -40.9 11.36 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.325 0.25 . . . . 70.12 111.23 -178.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.0 p -86.43 161.79 18.47 Favored 'General case' 0 N--CA 1.481 1.089 0 N-CA-C 109.589 -0.522 . . . . 74.13 109.589 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.483 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 24.3 ttmm -60.4 -42.02 95.09 Favored 'General case' 0 C--O 1.217 -0.63 0 O-C-N 123.708 0.63 . . . . 62.14 110.009 176.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -54.0 -47.01 71.91 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 124.186 0.929 . . . . 71.2 110.668 -178.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -68.93 -40.59 78.96 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 114.97 -1.014 . . . . 73.35 111.128 178.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.62 -22.99 67.19 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.46 0.704 . . . . 73.31 111.822 179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 28.6 mm-40 -85.73 -56.02 3.7 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.596 0.758 . . . . 74.3 110.711 177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -70.81 -43.53 68.43 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 112.257 0.466 . . . . 72.21 112.257 -170.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -69.49 -35.66 75.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.205 0.602 . . . . 74.42 111.026 -177.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.474 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.79 -51.7 67.24 Favored 'General case' 0 C--O 1.217 -0.621 0 O-C-N 124.208 0.943 . . . . 42.42 109.579 172.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.41 -48.05 72.07 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.863 0.865 . . . . 44.42 112.701 -175.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.38 -38.34 81.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 C-N-CA 123.69 0.796 . . . . 74.15 110.025 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.433 HD21 ' HB ' ' A' ' 58' ' ' THR . 22.7 tp -75.41 -27.65 59.1 Favored 'General case' 0 CA--C 1.552 1.042 0 CA-C-N 115.554 -0.748 . . . . 74.34 111.496 -178.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.539 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -65.45 -40.1 87.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 N-CA-C 108.716 -0.846 . . . . 75.45 108.716 173.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -63.94 -40.3 96.12 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 123.975 0.797 . . . . 72.14 111.128 176.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 82.4 t -60.11 -47.03 93.56 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.689 0.795 . . . . 60.04 110.56 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.98 -29.41 63.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.33 0.652 . . . . 73.34 111.964 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.74 -32.83 71.59 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.98 0.512 . . . . 72.34 110.688 177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -65.0 -42.84 94.14 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.558 0.743 . . . . 71.13 111.387 176.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.589 HD22 ' HB2' ' A' ' 49' ' ' LYS . 57.9 mt -86.86 -21.54 26.32 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 115.627 -0.715 . . . . 73.12 111.925 -174.361 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -167.08 89.37 0.1 OUTLIER Glycine 0 C--N 1.337 0.593 0 N-CA-C 110.638 -0.985 . . . . 71.52 110.638 -178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -69.31 85.88 0.4 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 123.881 0.872 . . . . 72.5 110.233 -178.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -143.39 -168.24 2.77 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.488 1.515 . . . . 64.52 108.319 -177.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -72.18 139.99 48.52 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 109.096 -0.705 . . . . 65.12 109.096 169.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 37.8 mm -112.16 125.99 69.5 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 C-N-CA 123.753 0.821 . . . . 70.43 109.444 -172.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -90.62 109.88 21.04 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.982 0.513 . . . . 74.13 109.651 -177.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.539 HG22 HD11 ' A' ' 76' ' ' ILE . 9.7 t -99.65 145.24 10.93 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.674 0 C-N-CA 123.865 0.866 . . . . 72.14 109.807 178.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.3 m -144.45 145.49 31.93 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.464 1.105 . . . . 75.22 108.429 177.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 16.0 t90 -118.07 106.14 12.57 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.691 -0.855 . . . . 73.44 108.691 172.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.83 -12.15 60.02 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.959 0.904 . . . . 75.04 112.075 -177.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 98.4 112.36 3.17 Favored Glycine 0 C--N 1.341 0.831 0 N-CA-C 109.937 -1.265 . . . . 70.31 109.937 -171.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.5 t70 72.44 -1.33 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.693 1.197 . . . . 74.44 110.477 -176.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.4 m -147.03 131.98 18.14 Favored 'General case' 0 C--N 1.358 0.958 0 C-N-CA 124.051 0.94 . . . . 74.23 109.962 -174.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 26.0 m -95.61 142.6 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 N-CA-C 109.16 -0.682 . . . . 70.11 109.16 163.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 53.9 m -135.73 135.97 40.43 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.942 0.897 . . . . 74.2 109.72 -178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.05 127.05 70.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 123.929 0.892 . . . . 34.05 108.986 174.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -152.07 132.32 13.62 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 123.639 0.776 . . . . 72.14 109.633 172.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.2 -134.19 24.77 Favored Glycine 0 C--N 1.342 0.895 0 O-C-N 123.626 0.579 . . . . 75.3 113.752 172.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -146.61 135.13 22.03 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.425 0.69 . . . . 72.55 109.589 -172.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -77.87 104.85 8.68 Favored 'General case' 0 C--N 1.35 0.589 0 C-N-CA 122.945 0.498 . . . . 73.02 109.789 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -69.43 -26.8 64.79 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.846 -0.615 . . . . 75.15 110.748 173.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 80.95 150.94 7.49 Favored Glycine 0 C--N 1.352 1.431 0 CA-C-N 115.919 -0.582 . . . . 64.41 111.918 -177.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 34.9 m -89.56 140.6 15.58 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 122.776 0.43 . . . . 74.34 110.06 179.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 32.4 t70 . . . . . 0 C--O 1.247 0.921 0 C-N-CA 123.217 0.607 . . . . 71.43 109.688 179.393 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.3 mtt . . . . . 0 N--CA 1.484 1.237 0 N-CA-C 109.086 -0.709 . . . . 63.04 109.086 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.6 p80 -114.45 172.32 7.09 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.059 0.944 . . . . 74.42 109.979 -179.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.6 m80 -140.48 166.21 25.33 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.6 0.76 . . . . 71.31 110.189 176.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -64.64 126.23 27.24 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.431 1.092 . . . . 63.54 110.525 -179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.9 m80 -72.68 95.09 1.82 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.355 0.662 . . . . 53.52 109.893 178.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.6 t-160 -123.21 -62.86 1.3 Allowed 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.791 0.837 . . . . 62.31 109.229 -178.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.9 p80 -99.96 17.73 20.22 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.536 0.734 . . . . 65.14 109.996 173.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 mtp85 -120.58 119.73 33.74 Favored 'General case' 0 C--N 1.352 0.679 0 C-N-CA 123.723 0.809 . . . . 72.14 110.561 -178.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.0 t -162.35 159.7 25.68 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 125.185 1.394 . . . . 55.22 108.561 174.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.551 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 101.0 -32.7 7.15 Favored Glycine 0 C--N 1.342 0.862 0 CA-C-O 119.809 -0.439 . . . . 51.05 112.572 -179.593 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -59.75 127.71 33.31 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.237 0.615 . . . . 70.45 109.604 178.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.579 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 53.6 mt -76.81 100.25 2.45 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 N-CA-C 109.301 -0.629 . . . . 70.22 109.301 -175.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -92.43 110.33 21.74 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.273 -1.01 . . . . 75.45 108.273 174.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 16.1 t -95.4 111.86 26.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 N-CA-C 107.452 -1.314 . . . . 65.12 107.452 173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -128.73 111.72 13.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.736 -0.839 . . . . 60.43 108.736 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.54 ' HB3' ' HB3' ' A' ' 27' ' ' TYR . 24.9 t-20 -103.28 128.86 50.2 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 109.236 -0.653 . . . . 75.15 109.236 173.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -102.41 143.96 31.48 Favored 'General case' 0 C--O 1.232 0.181 0 N-CA-C 106.399 -1.704 . . . . 72.24 106.399 169.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -140.83 129.94 23.42 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.478 -0.934 . . . . 75.35 108.478 -169.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.8 p -93.11 111.75 23.48 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.836 -0.801 . . . . 51.4 108.836 -175.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 51.7 t -165.69 165.05 18.92 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 125.122 1.369 . . . . 75.22 108.599 -177.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -89.86 -25.24 21.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.999 0.519 . . . . 63.3 110.139 177.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -94.96 97.75 2.19 Favored Glycine 0 C--N 1.349 1.263 0 N-CA-C 111.789 -0.524 . . . . 74.12 111.789 -179.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -69.35 109.33 4.11 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 123.538 0.735 . . . . 70.11 110.313 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.493 HG21 ' HG3' ' A' ' 51' ' ' GLN . 63.4 p -77.43 -166.12 0.7 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.997 0.919 . . . . 72.54 109.843 173.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -61.98 -70.5 0.19 Allowed 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.816 -0.438 . . . . 62.53 109.816 -177.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -177.88 178.21 0.99 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.504 1.122 . . . . 73.23 109.622 171.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.54 ' HB3' ' HB3' ' A' ' 16' ' ' ASN . 95.0 m-85 -132.24 23.09 4.46 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.089 0.955 . . . . 64.13 110.141 -177.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 43.3 m -113.27 121.22 43.78 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.316 0.647 . . . . 74.35 111.619 -172.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.55 125.13 35.54 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.399 1.079 . . . . 74.11 108.486 175.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 23.6 m -107.61 103.68 13.04 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.351 -0.981 . . . . 71.2 108.351 179.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' HB ' ' A' ' 12' ' ' ILE . 28.0 m -109.44 176.91 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.876 1.27 . . . . 71.23 109.2 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.3 t -130.57 -30.01 1.91 Allowed 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.258 0.623 . . . . 72.43 110.014 176.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.457 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 26.5 m -88.09 138.78 31.14 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.157 0.583 . . . . 72.23 110.37 178.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.11 -29.2 61.72 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 124.042 0.937 . . . . 72.24 112.358 -173.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 89.2 p -67.7 -32.46 73.13 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.143 0.497 . . . . 64.01 110.266 175.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.457 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 11.6 mm-40 -76.58 -30.06 56.86 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 115.31 -0.859 . . . . 74.41 110.556 177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 24.2 tp -58.97 -42.17 89.29 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.087 0.555 . . . . 70.04 110.803 172.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -59.78 -44.83 93.72 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.72 0.808 . . . . 61.3 110.705 178.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.4 ptmt -66.39 -38.2 86.97 Favored 'General case' 0 CA--C 1.549 0.908 0 CA-C-N 115.401 -0.818 . . . . 73.31 109.992 -179.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 39.9 t -62.79 -44.98 99.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.665 0.786 . . . . 73.55 110.525 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.472 ' HB3' HG21 ' A' ' 78' ' ' VAL . 91.7 mt -70.74 -24.04 62.54 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.152 0.581 . . . . 72.43 111.649 -179.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -71.06 -52.24 20.64 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.553 0.741 . . . . 60.45 109.231 176.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.41 -40.0 92.86 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.137 0.575 . . . . 65.44 111.04 177.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 49.7 tp -66.13 -35.59 80.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.754 0.822 . . . . 60.41 110.322 -177.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' O ' HD21 ' A' ' 82' ' ' LEU . 39.1 ttpt -56.97 -42.69 80.62 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 115.83 -0.623 . . . . 71.21 110.303 173.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -66.35 -40.26 89.69 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.231 0.612 . . . . 74.53 110.921 177.132 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 38.5 m-85 -62.74 -40.61 97.75 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.939 0.496 . . . . 73.15 112.185 -179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 69.2 mt -77.84 -29.97 16.23 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.124 0 C-N-CA 123.442 0.697 . . . . 71.41 110.31 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 24.6 ttpp -74.34 -34.57 63.46 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.475 0.71 . . . . 75.23 110.846 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -85.54 -38.53 18.42 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.28 1.032 . . . . 55.03 110.242 -179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.493 ' HG3' HG21 ' A' ' 24' ' ' THR . 86.2 mm-40 -133.25 103.59 6.06 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.268 1.027 . . . . 74.44 108.403 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -177.99 93.29 0.09 OUTLIER Glycine 0 C--N 1.342 0.863 0 N-CA-C 111.332 -0.707 . . . . 75.33 111.332 -178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 82.4 m -73.4 -70.09 0.39 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 123.141 0.577 . . . . 42.42 111.747 -176.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -113.97 -86.73 0.58 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.196 0.598 . . . . 71.24 110.709 -172.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -103.49 136.45 43.2 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 124.565 1.146 . . . . 55.43 110.579 -172.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.512 ' HB3' HD21 ' A' ' 16' ' ' ASN . 50.2 m -134.87 111.26 9.73 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 108.186 -1.042 . . . . 62.12 108.186 178.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.469 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 25.2 ttm180 -104.48 108.28 19.63 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.248 1.019 . . . . 74.02 109.599 -177.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 85.0 m -101.6 126.1 48.37 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.77 -0.826 . . . . 75.42 108.77 172.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 22.0 t -116.04 119.78 36.99 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 107.843 -1.169 . . . . 61.34 107.843 178.496 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.8 mt -110.4 133.51 55.58 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.995 0 C-N-CA 124.706 1.203 . . . . 72.02 108.054 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.579 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 71.9 m -64.05 127.32 30.89 Favored 'General case' 0 CA--C 1.547 0.854 0 CA-C-O 120.986 0.422 . . . . 73.32 110.313 176.11 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -155.73 99.59 2.01 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.35 1.46 . . . . 62.31 107.191 -172.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.551 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 14.4 mtm180 -73.15 -62.9 1.3 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.443 0.697 . . . . 74.53 111.745 -166.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 18.1 p -98.09 179.57 4.72 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 116.158 -0.474 . . . . 63.42 110.493 -176.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.413 ' HA ' ' HE2' ' A' ' 65' ' ' LYS . 0.6 OUTLIER -63.95 -26.75 68.73 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.436 1.094 . . . . 64.11 111.411 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -71.0 -51.77 23.49 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.534 0.733 . . . . 74.14 110.469 177.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -59.6 -36.38 76.18 Favored 'General case' 0 N--CA 1.486 1.334 0 O-C-N 123.535 0.522 . . . . 71.41 110.578 175.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.5 -47.78 82.97 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.119 -0.946 . . . . 64.33 111.454 178.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -62.91 -58.4 7.49 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.514 0.725 . . . . 71.4 112.029 178.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.4 ptmm? -66.21 -35.62 80.9 Favored 'General case' 0 CA--C 1.552 1.026 0 CA-C-N 115.417 -0.811 . . . . 74.1 112.73 -167.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -84.03 -30.93 25.72 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.963 0.505 . . . . 71.24 111.586 -178.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.98 -48.37 79.14 Favored 'General case' 0 N--CA 1.477 0.913 0 O-C-N 123.408 0.443 . . . . 71.14 110.647 176.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -50.03 -49.08 52.17 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 124.005 0.922 . . . . 71.12 112.418 -176.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 44.0 mt -65.26 -41.42 91.45 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.943 0 CA-C-N 114.859 -1.064 . . . . 73.13 110.68 -178.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.6 tp -73.85 -30.21 62.54 Favored 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 123.346 0.659 . . . . 72.42 111.65 -176.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.596 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -65.78 -40.58 88.1 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.765 -0.828 . . . . 74.51 108.765 173.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 56.7 mtpt -63.69 -39.84 95.32 Favored 'General case' 0 N--CA 1.484 1.269 0 O-C-N 123.573 0.546 . . . . 74.21 111.778 175.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.472 HG21 ' HB3' ' A' ' 41' ' ' LEU . 59.7 t -56.08 -53.82 34.43 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 123.647 0.779 . . . . 74.32 110.141 176.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 46.3 m-85 -73.64 -18.23 61.06 Favored 'General case' 0 N--CA 1.479 1.023 0 N-CA-C 112.731 0.641 . . . . 74.12 112.731 179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -73.79 -34.36 64.6 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.089 0.556 . . . . 55.01 110.821 176.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -78.26 -35.74 47.71 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.537 -0.756 . . . . 71.11 110.338 175.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.412 HD21 ' O ' ' A' ' 45' ' ' LYS . 97.8 mt -70.14 -28.14 65.13 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.331 0.652 . . . . 63.53 111.372 176.333 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -159.09 123.64 1.27 Allowed Glycine 0 C--N 1.341 0.835 0 N-CA-C 111.368 -0.693 . . . . 72.04 111.368 -177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -74.57 2.5 9.59 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.698 0.799 . . . . 72.35 112.67 -178.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.541 ' HB3' ' NE2' ' A' ' 101' ' ' GLN . 0.9 OUTLIER -74.03 162.86 28.58 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.389 0.676 . . . . 74.25 110.19 173.248 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.99 149.34 32.32 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.366 0.667 . . . . 73.34 110.963 174.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 26.5 mm -105.31 149.45 8.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.025 0.53 . . . . 71.32 109.835 -177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -115.57 129.78 56.64 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.025 -0.732 . . . . 65.33 109.025 171.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.596 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.7 p -117.13 142.93 28.87 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.346 1.058 . . . . 73.53 108.964 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 90.0 m -142.5 133.63 25.98 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 123.834 0.854 . . . . 73.13 108.728 174.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.1 t90 -110.5 109.48 19.84 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.67 -0.863 . . . . 65.43 108.67 176.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -64.84 -49.54 70.17 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.393 1.077 . . . . 62.21 110.685 179.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.77 -48.58 0.44 Allowed Glycine 0 C--N 1.341 0.807 0 CA-C-N 114.823 -1.081 . . . . 65.5 111.408 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 12.2 m-20 -113.28 -0.45 14.57 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 123.338 0.655 . . . . 74.03 111.347 175.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 8.1 p -144.61 139.71 28.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.837 0.855 . . . . 71.1 110.79 -179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 76.3 t -95.58 108.21 20.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 108.408 -0.96 . . . . 61.41 108.408 163.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 80.8 m -94.56 110.37 22.19 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 124.253 1.021 . . . . 72.35 109.661 175.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.42 121.87 62.08 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 108.718 -0.845 . . . . 75.32 108.718 174.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -132.74 115.42 15.32 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 107.753 -1.203 . . . . 52.24 107.753 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 21.2 -94.66 0.01 OUTLIER Glycine 0 N--CA 1.487 2.067 0 O-C-N 125.808 1.943 . . . . 74.43 115.871 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.541 ' NE2' ' HB3' ' A' ' 85' ' ' ASN . 7.3 pt20 -155.55 158.7 38.88 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.667 1.187 . . . . 64.45 109.982 166.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 87.2 mt -85.51 147.42 26.45 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 108.507 -0.923 . . . . 73.21 108.507 167.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -71.31 -7.81 49.51 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.614 0.766 . . . . 64.02 112.07 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -160.98 -148.79 5.4 Favored Glycine 0 C--N 1.341 0.812 0 N-CA-C 110.865 -0.894 . . . . 74.24 110.865 171.361 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.1 m -95.1 155.09 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.463 0.705 . . . . 71.3 109.726 175.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 37.6 t70 . . . . . 0 C--O 1.254 1.314 0 CA-C-O 118.891 -0.576 . . . . 63.31 109.983 178.451 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.4 ttm . . . . . 0 N--CA 1.481 1.107 0 N-CA-C 109.731 -0.47 . . . . 44.12 109.731 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.5 t60 -124.88 135.61 53.04 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.123 0.969 . . . . 65.12 109.054 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -65.83 116.4 6.96 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 123.697 0.623 . . . . 74.23 109.526 175.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -66.85 -30.45 70.62 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.438 0.695 . . . . 73.23 109.452 -178.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.55 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 46.0 p-80 -82.1 88.96 6.42 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-O 122.241 1.019 . . . . 75.11 109.047 174.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.8 t-80 -105.43 33.64 3.62 Favored 'General case' 0 CA--C 1.549 0.933 0 N-CA-C 108.745 -0.835 . . . . 73.02 108.745 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 64.44 18.38 11.31 Favored 'General case' 0 CA--C 1.562 1.405 0 C-N-CA 125.292 1.437 . . . . 74.13 111.272 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.5 mmm180 -93.55 93.19 7.94 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.188 0.995 . . . . 71.53 111.132 -177.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.5 t -67.38 148.71 51.26 Favored 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.948 0.899 . . . . 64.04 110.118 170.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 159.3 -109.74 0.41 Allowed Glycine 0 C--N 1.346 1.109 0 N-CA-C 111.586 -0.606 . . . . 64.22 111.586 -176.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 56.2 m-20 -75.5 116.73 16.53 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.349 0.595 . . . . 73.22 110.642 -175.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.1 mt -95.35 108.04 20.4 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.754 0 C-N-CA 125.049 1.34 . . . . 64.23 109.573 -177.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -85.38 118.07 24.69 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 109.429 -0.582 . . . . 72.02 109.429 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.7 t -104.35 114.67 44.57 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 124.931 1.292 . . . . 70.42 108.846 178.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -133.36 131.19 39.79 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 122.946 0.498 . . . . 73.11 110.286 179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 16.0 t-20 -121.09 143.76 48.91 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.917 0.887 . . . . 62.22 109.464 174.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -130.46 139.79 50.55 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.389 1.075 . . . . 72.3 108.794 -177.545 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 35.7 m-80 -126.62 123.36 37.44 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.33 1.052 . . . . 54.31 108.21 179.497 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.0 t -92.51 114.0 26.42 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 109.317 -0.623 . . . . 52.03 109.317 -176.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 25.2 p -169.83 -165.27 0.48 Allowed 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 124.474 1.11 . . . . 65.02 108.713 -177.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -63.32 -36.66 84.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.408 0.683 . . . . 72.55 110.52 171.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -76.01 103.03 1.62 Allowed Glycine 0 C--N 1.347 1.187 0 O-C-N 123.432 0.457 . . . . 72.24 112.357 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.2 tmtt? -78.36 85.23 4.49 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 108.096 -1.075 . . . . 71.23 108.096 179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.0 t -81.25 138.3 35.78 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-O 121.579 0.704 . . . . 60.1 111.608 -173.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 39.7 p90 -138.46 16.52 2.75 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.8 1.64 . . . . 74.21 107.651 175.189 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -88.73 -36.44 16.14 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 114.686 -1.143 . . . . 72.52 111.083 -165.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -79.93 74.13 6.68 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.3 -0.863 . . . . 73.2 110.491 -175.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.9 m -142.04 124.73 15.92 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.865 0.466 . . . . 74.15 110.653 176.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -132.58 154.01 50.45 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 125.031 1.332 . . . . 72.11 107.48 175.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 50.1 m -126.02 104.91 8.53 Favored 'General case' 0 C--O 1.239 0.538 0 N-CA-C 107.637 -1.246 . . . . 71.33 107.637 170.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.7 m -102.0 152.21 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.748 -0.834 . . . . 63.54 108.748 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.5 t -119.78 -14.48 9.0 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.893 0.477 . . . . 71.23 110.53 -178.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.453 HG22 ' H ' ' A' ' 35' ' ' SER . 26.9 m -116.59 142.07 47.37 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.132 -1.062 . . . . 73.23 108.132 172.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -75.15 -19.11 60.04 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.492 0.717 . . . . 72.34 111.343 -175.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.453 ' H ' HG22 ' A' ' 33' ' ' THR . 24.8 m -67.34 -39.0 85.77 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.267 0.627 . . . . 54.51 110.206 172.382 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.428 ' HG3' ' HB ' ' A' ' 33' ' ' THR . 56.6 mt-10 -66.47 -35.74 81.03 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.96 0.904 . . . . 62.21 109.985 176.153 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -60.58 -50.76 72.25 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 114.993 -1.003 . . . . 74.21 110.839 176.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -59.65 -27.17 66.13 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.83 0.852 . . . . 74.04 112.097 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -74.44 -55.13 6.31 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.769 0.827 . . . . 61.23 110.634 175.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 21.7 m -67.17 -22.77 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 CA-C-N 116.064 -0.517 . . . . 73.13 112.172 -172.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 97.7 mt -80.25 -36.21 34.97 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.367 0.667 . . . . 74.31 111.495 177.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 39.2 t-20 -67.58 -38.41 84.03 Favored 'General case' 0 N--CA 1.48 1.073 0 N-CA-C 108.815 -0.809 . . . . 74.25 108.815 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.3 tt0 -71.8 -44.86 63.23 Favored 'General case' 0 CA--C 1.551 0.994 0 CA-C-N 114.555 -1.202 . . . . 62.1 111.194 176.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 48' ' ' ILE . 50.9 tp -57.44 -43.83 84.23 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.56 1.144 . . . . 65.11 110.39 178.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.442 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.7 ttpt -56.1 -44.72 79.31 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.016 1.326 . . . . 61.23 111.757 175.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -62.2 -34.01 75.64 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.823 0.849 . . . . 74.43 110.867 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -72.97 -46.42 52.47 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.561 0.745 . . . . 74.41 111.501 177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 44' ' ' LEU . 84.6 mt -68.36 -37.58 78.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 124.144 0.978 . . . . 74.13 111.265 -175.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -60.9 -34.5 74.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.407 0.683 . . . . 62.15 111.457 -178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -76.28 -37.93 56.84 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 115.198 -0.91 . . . . 71.23 109.985 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -96.27 77.48 3.04 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 121.431 0.634 . . . . 62.51 110.488 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -79.73 70.62 2.85 Favored Glycine 0 C--N 1.345 1.031 0 N-CA-C 110.694 -0.962 . . . . 75.42 110.694 174.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 19.3 p -70.99 -86.32 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 123.83 0.852 . . . . 63.12 111.847 -169.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.8 mmmp? -146.14 -61.21 0.32 Allowed 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.384 1.074 . . . . 64.44 108.32 178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -137.91 126.16 23.1 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 115.556 -0.747 . . . . 71.52 109.114 175.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 36.0 m -97.1 136.69 37.27 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 124.154 0.982 . . . . 51.22 108.512 173.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.4 ttm-85 -133.97 107.61 7.9 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 108.205 -1.035 . . . . 74.13 108.205 -175.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 30.0 m -107.15 133.76 51.27 Favored 'General case' 0 N--CA 1.477 0.887 0 CA-C-N 118.361 0.528 . . . . 70.13 109.646 -177.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.44 ' HB3' HG21 ' A' ' 95' ' ' THR . 32.0 m -130.64 121.9 26.42 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 124.513 1.125 . . . . 64.22 109.276 -171.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 59.5 mt -119.81 128.68 75.92 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 123.987 0.915 . . . . 73.32 108.802 177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.9 m -66.41 114.65 5.58 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-O 120.935 0.398 . . . . 73.22 110.969 -178.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.512 ' HB3' HG23 ' A' ' 96' ' ' VAL . . . -143.93 114.67 7.7 Favored 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.429 -1.323 . . . . 71.24 107.429 -178.094 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.35 -29.56 10.19 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.982 0.913 . . . . 71.31 109.812 -173.151 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 29.6 p -100.73 159.16 15.41 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.499 -0.556 . . . . 70.11 109.499 176.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.431 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 18.8 ptpt -65.9 -33.14 75.14 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.467 0.707 . . . . 63.31 111.847 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -64.46 -48.25 75.97 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.882 0.473 . . . . 75.42 110.021 -178.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -57.25 -46.3 83.16 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.592 1.182 . . . . 65.41 110.534 173.455 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.483 ' HA ' HG21 ' A' ' 96' ' ' VAL . . . -57.68 -42.08 82.92 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.885 -1.052 . . . . 63.24 112.063 -176.611 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 31.8 mm-40 -72.4 -50.89 23.13 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 123.801 0.688 . . . . 61.41 112.0 -177.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -74.78 -39.04 61.97 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 113.022 0.749 . . . . 73.45 113.022 -171.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 16.1 m-30 -68.93 -40.68 78.88 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.966 0.506 . . . . 72.31 110.248 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.637 ' HB2' HG11 ' A' ' 96' ' ' VAL . . . -61.93 -41.73 98.28 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 115.14 -0.937 . . . . 75.53 111.209 174.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.26 -47.23 75.77 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 124.037 0.836 . . . . 64.21 111.203 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 32.5 mt -60.51 -37.14 74.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 CA-C-N 115.833 -0.621 . . . . 72.42 110.167 177.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 71.2 mt -72.85 -25.69 61.19 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 112.746 0.647 . . . . 74.03 112.746 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.7 mp -69.94 -37.55 73.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.089 0 N-CA-C 108.87 -0.789 . . . . 34.24 108.87 172.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.02 -52.5 63.72 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 123.164 0.29 . . . . 74.12 110.343 172.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.475 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 39.7 t -51.82 -54.85 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.132 0 C-N-CA 125.018 1.327 . . . . 44.11 110.84 -179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.481 ' HB3' HD12 ' A' ' 87' ' ' ILE . 7.0 m-85 -69.67 -29.73 67.25 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.183 -0.917 . . . . 72.04 112.736 -176.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.08 -31.4 70.11 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 120.762 0.315 . . . . 74.02 110.651 176.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -78.38 -30.69 48.03 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.344 0.658 . . . . 75.02 110.887 174.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 94.5 mt -74.23 -24.95 59.39 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.43 0.692 . . . . 73.54 111.011 175.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -176.11 110.58 0.31 Allowed Glycine 0 C--N 1.339 0.708 0 N-CA-C 110.638 -0.985 . . . . 43.35 110.638 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 59.4 t80 -74.77 96.54 3.08 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 122.945 0.498 . . . . 75.14 110.018 -175.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -163.39 -172.44 2.95 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.002 0.921 . . . . 53.23 109.068 177.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.35 108.85 6.45 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 109.523 -0.547 . . . . 73.52 109.523 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.481 HD12 ' HB3' ' A' ' 79' ' ' TYR . 36.9 mm -86.5 129.43 38.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 C-N-CA 123.341 0.656 . . . . 72.1 110.816 -176.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 62.4 t30 -93.73 142.36 27.44 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.043 0.537 . . . . 74.02 110.595 -178.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 5.8 p -122.95 143.27 36.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 124.092 0.957 . . . . 61.41 109.436 176.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 86.0 m -140.29 138.39 34.93 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.542 0.737 . . . . 71.32 109.062 174.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 13.6 t90 -115.05 114.05 24.86 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.548 -0.908 . . . . 74.3 108.548 174.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -66.88 -55.82 13.03 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.433 1.093 . . . . 75.42 110.529 177.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.18 -57.4 0.37 Allowed Glycine 0 C--N 1.338 0.684 0 N-CA-C 109.62 -1.392 . . . . 71.1 109.62 -175.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.55 ' HA ' ' HB3' ' A' ' 5' ' ' HIS . 57.9 m-20 -75.86 -36.53 59.53 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 121.488 0.661 . . . . 72.23 109.989 174.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.44 HG21 ' HB3' ' A' ' 59' ' ' SER . 97.8 m -144.19 139.85 28.98 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.726 -1.124 . . . . 50.22 111.138 -163.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.637 HG11 ' HB2' ' A' ' 72' ' ' ALA . 82.5 t -92.58 119.67 40.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 C-N-CA 123.747 0.819 . . . . 71.05 109.236 170.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -110.73 108.51 18.41 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.792 0.837 . . . . 72.34 109.846 177.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 55.1 t -91.72 135.06 28.13 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 N-CA-C 107.651 -1.24 . . . . 54.11 107.651 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -149.45 160.11 43.73 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.349 -0.611 . . . . 75.4 109.349 -170.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.54 153.37 45.93 Favored Glycine 0 C--N 1.346 1.096 0 CA-C-N 116.327 -0.397 . . . . 42.23 112.269 175.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -73.56 124.67 26.35 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.818 0.447 . . . . 72.25 110.533 -177.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.2 tt -70.93 111.18 6.13 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 106.965 -1.495 . . . . 62.44 106.965 168.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -59.77 126.08 26.16 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.776 0.672 . . . . 63.13 110.942 -177.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -149.12 -85.1 0.05 OUTLIER Glycine 0 C--N 1.334 0.42 0 N-CA-C 109.334 -1.507 . . . . 72.54 109.334 176.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.8 m -122.27 152.81 26.55 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.704 0 C-N-CA 123.941 0.897 . . . . 63.42 109.39 174.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 . . . . . 0 C--O 1.244 0.808 0 C-N-CA 123.728 0.811 . . . . 63.33 109.898 -176.151 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.1 mtm . . . . . 0 N--CA 1.484 1.225 0 N-CA-C 110.48 -0.193 . . . . 73.42 110.48 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.4 t-80 -148.65 -65.81 0.24 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.111 0.964 . . . . 63.43 108.565 171.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -82.33 102.74 11.42 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 108.95 -0.759 . . . . 73.23 108.95 175.503 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 p-80 -80.38 40.43 0.49 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 123.672 0.789 . . . . 73.15 112.697 -174.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.3 t60 -168.89 118.5 0.71 Allowed 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 106.845 -1.539 . . . . 64.03 106.845 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 38.9 t60 -76.39 107.56 8.74 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.87 -0.789 . . . . 73.34 108.87 177.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -77.51 123.43 26.57 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.685 -0.858 . . . . 71.02 108.685 171.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 17.1 tpp180 -65.66 106.59 1.51 Allowed 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 108.944 -0.762 . . . . 71.34 108.944 170.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.2 t -115.04 23.99 12.07 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 125.017 1.327 . . . . 75.14 109.929 -175.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.3 51.88 48.78 Favored Glycine 0 C--N 1.351 1.407 0 N-CA-C 110.615 -0.994 . . . . 50.01 110.615 -169.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -78.35 135.0 37.39 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.452 0.701 . . . . 71.21 110.393 -170.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.471 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 58.6 mt -77.94 101.6 3.76 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.669 0 N-CA-C 108.212 -1.033 . . . . 72.04 108.212 175.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -97.76 106.32 18.61 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 109.103 -0.703 . . . . 73.44 109.103 -179.724 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 12.0 t -93.71 118.85 40.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.527 1.131 . . . . 64.32 108.638 178.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -128.99 132.34 47.53 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.019 0.527 . . . . 73.2 109.704 -179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 57' ' ' ARG . 12.0 t-20 -107.53 137.21 45.98 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 109.687 -0.486 . . . . 61.01 109.687 170.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -104.63 112.93 26.2 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.406 -0.961 . . . . 74.33 108.406 172.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -109.11 125.34 52.04 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.737 0.815 . . . . 73.22 110.308 -173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -95.46 109.88 22.01 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 108.042 -1.096 . . . . 64.41 108.042 172.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.4 m 177.45 169.92 0.61 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 127.07 2.148 . . . . 72.44 107.139 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -131.57 145.49 51.74 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.09 0.556 . . . . 73.45 109.523 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.0 -107.63 0.83 Allowed Glycine 0 C--N 1.343 0.972 0 O-C-N 123.929 0.768 . . . . 51.14 111.512 178.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -88.65 38.68 0.88 Allowed 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.922 0.889 . . . . 63.3 111.455 -178.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.1 p -80.07 83.04 6.02 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-O 121.815 0.817 . . . . 61.41 111.231 -178.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -85.97 132.36 34.09 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 107.653 -1.24 . . . . 61.1 107.653 167.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -73.55 86.81 1.6 Allowed 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 108.454 -0.943 . . . . 75.53 108.454 174.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.1 p90 -77.33 73.3 3.91 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-O 122.846 1.308 . . . . 75.21 110.223 -179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.3 m -90.02 120.65 31.4 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 113.971 -1.468 . . . . 74.42 107.948 175.564 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -109.49 143.04 39.68 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.872 -1.158 . . . . 73.33 107.872 -177.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.7 m -126.87 104.21 7.91 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 108.606 -0.887 . . . . 72.43 108.606 175.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.6 m -104.71 130.05 56.27 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 124.193 0.997 . . . . 72.25 108.551 177.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 9.9 t -89.12 1.07 56.15 Favored 'General case' 0 CA--C 1.552 1.036 0 O-C-N 122.107 -0.371 . . . . 71.02 111.551 -172.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 51.3 m -136.16 143.89 44.71 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.465 0.706 . . . . 73.35 110.643 -176.787 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -61.4 -37.82 84.83 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.25 1.02 . . . . 72.43 111.548 -179.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 28.9 m -60.68 -36.42 78.72 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.551 0.74 . . . . 64.33 111.902 178.374 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 39' ' ' LYS . 54.0 mm-40 -72.0 -20.59 61.69 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.721 0.808 . . . . 73.13 112.021 179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.404 HD11 HD13 ' A' ' 60' ' ' ILE . 61.3 tp -65.42 -51.89 57.17 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 122.962 0.505 . . . . 62.1 110.771 176.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -55.34 -30.9 61.16 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.923 0.889 . . . . 63.3 111.547 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 54.6 mtpt -73.43 -55.66 6.07 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.156 0.983 . . . . 74.22 110.714 177.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 8.1 p -70.47 -26.04 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.086 0 N-CA-C 112.617 0.599 . . . . 75.22 112.617 -168.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB3' HG21 ' A' ' 78' ' ' VAL . 53.3 mt -68.33 -30.9 69.97 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.352 0.661 . . . . 44.0 111.374 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -63.47 -37.26 86.61 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.61 0.764 . . . . 70.22 110.398 175.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -74.98 -52.36 11.33 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.957 0.903 . . . . 74.22 110.497 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.1 tt -56.34 -35.65 67.85 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.797 1.239 . . . . 74.01 110.836 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt -53.86 -51.03 64.91 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.286 1.434 . . . . 72.1 111.948 174.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -70.48 -23.95 62.77 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.744 -0.662 . . . . 74.23 111.863 -178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -67.06 -48.56 67.87 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.774 0.43 . . . . 74.23 110.295 174.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 67.1 mt -59.0 -48.0 88.08 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.404 0.682 . . . . 74.32 110.334 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.18 -44.44 75.91 Favored 'General case' 0 CA--C 1.55 0.948 0 CA-C-N 114.742 -1.117 . . . . 70.21 111.603 -172.004 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -74.59 -42.06 59.38 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.048 0.539 . . . . 71.1 111.141 -176.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 28.2 mm-40 -73.2 -18.74 61.22 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 122.54 0.336 . . . . 75.1 111.069 178.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 66.64 46.72 73.57 Favored Glycine 0 C--N 1.356 1.661 0 O-C-N 123.459 0.474 . . . . 21.32 111.992 178.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 60.5 m -60.28 111.19 1.45 Allowed 'General case' 0 C--O 1.24 0.582 0 C-N-CA 123.64 0.776 . . . . 63.41 110.408 -176.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.0 tptp -60.5 -36.17 77.71 Favored 'General case' 0 N--CA 1.477 0.879 0 O-C-N 124.621 1.201 . . . . 75.14 109.994 -171.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 7.1 tpt180 -137.34 137.91 39.4 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.99 -1.115 . . . . 75.12 107.99 168.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.5 p -137.82 135.22 36.04 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 122.842 0.457 . . . . 51.55 110.332 -178.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 16' ' ' ASN . 49.0 ttt180 -126.51 110.3 13.12 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.646 0.779 . . . . 73.44 109.161 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.668 ' HB ' HD21 ' A' ' 75' ' ' LEU . 8.7 m -97.45 132.87 42.74 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.449 -0.945 . . . . 72.51 108.449 175.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 71.1 m -136.33 120.68 18.01 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 108.596 -0.89 . . . . 54.42 108.596 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.404 HD13 HD11 ' A' ' 37' ' ' LEU . 74.7 mt -110.79 133.51 56.04 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 124.396 1.078 . . . . 74.31 109.739 -176.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.471 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 51.6 m -63.07 116.61 5.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.648 0.779 . . . . 73.22 110.919 176.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -166.38 99.01 0.6 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.968 0.907 . . . . 72.35 109.392 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.54 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -101.24 -28.06 12.86 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.415 0.686 . . . . 72.24 110.042 175.452 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 14.2 p -71.59 119.61 16.0 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.898 -1.149 . . . . 64.11 107.898 169.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.512 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 36.9 ttpt -59.33 -40.62 86.88 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.884 0.874 . . . . 72.31 112.884 -166.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.0 mttp -56.66 -43.09 80.03 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.202 0.601 . . . . 73.2 111.103 177.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -67.95 -38.13 82.41 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.024 -0.989 . . . . 72.44 110.369 177.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.16 -36.76 78.29 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.976 0.51 . . . . 73.51 111.655 177.288 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 24.4 mm-40 -70.34 -54.97 10.35 Favored 'General case' 0 N--CA 1.477 0.892 0 O-C-N 123.998 0.812 . . . . 34.11 111.884 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -66.13 -41.99 89.73 Favored 'General case' 0 N--CA 1.478 0.953 0 CA-C-N 116.189 -0.459 . . . . 73.1 111.247 -175.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 11.5 m-30 -66.22 -35.52 80.64 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.392 0.677 . . . . 73.01 110.7 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.572 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -65.45 -44.8 86.12 Favored 'General case' 0 C--N 1.352 0.717 0 O-C-N 123.847 0.717 . . . . 75.32 111.106 174.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.12 -45.09 96.09 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.457 0.703 . . . . 42.2 111.603 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.417 ' O ' HG23 ' A' ' 78' ' ' VAL . 63.6 mt -67.08 -32.25 57.01 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.068 0 C-N-CA 124.319 1.048 . . . . 70.44 110.024 177.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.668 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.0 OUTLIER -72.84 -37.3 67.47 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 123.535 0.734 . . . . 74.23 110.406 178.476 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.561 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -61.66 -38.53 80.54 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.494 0.718 . . . . 63.32 109.321 173.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.439 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 2.0 tpmt? -59.26 -46.83 87.46 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.738 0.648 . . . . 61.05 110.686 175.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.418 HG21 ' HB3' ' A' ' 41' ' ' LEU . 88.8 t -60.45 -41.98 89.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 124.106 0.962 . . . . 74.4 111.176 178.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -75.25 -20.52 59.15 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.683 0.793 . . . . 72.21 112.027 179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -79.68 -33.65 40.95 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 122.918 0.487 . . . . 42.33 109.883 174.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 7.1 mm-40 -62.73 -31.34 72.25 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.972 0.909 . . . . 72.02 110.944 173.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 92.8 mt -96.24 -21.83 17.62 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.652 0.781 . . . . 74.25 111.524 -178.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.67 -100.99 0.18 Allowed Glycine 0 C--N 1.355 1.629 0 O-C-N 123.037 0.211 . . . . 61.14 113.28 -175.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 52.4 m-85 -132.76 171.85 13.33 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.606 0.763 . . . . 73.2 111.402 -171.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -83.66 -30.96 26.42 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.989 0.916 . . . . 74.33 111.104 179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -71.1 90.0 0.85 Allowed 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.222 -0.659 . . . . 71.21 109.222 174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.495 ' HA ' ' HA ' ' A' ' 101' ' ' GLN . 48.2 mm -122.23 144.02 32.97 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.143 0 C-N-CA 123.208 0.603 . . . . 54.15 109.595 -176.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -86.18 122.22 29.88 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.231 -0.655 . . . . 72.12 109.231 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.561 HG22 HD11 ' A' ' 76' ' ' ILE . 16.7 t -105.4 141.41 20.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 124.241 1.016 . . . . 51.04 108.79 176.247 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 61.7 m -141.53 105.87 4.83 Favored 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 107.055 -1.461 . . . . 64.41 107.055 171.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 26.7 t90 -92.64 105.31 17.48 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.057 -1.09 . . . . 72.13 108.057 177.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -55.49 -45.39 77.04 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 124.206 1.002 . . . . 74.12 110.854 176.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.444 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 135.17 -41.45 1.44 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.105 -0.952 . . . . 43.23 110.722 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.54 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 17.7 t70 -95.93 -36.57 11.03 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.875 0.87 . . . . 73.14 110.073 176.304 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 22.1 m -132.2 138.22 47.89 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 123.672 0.789 . . . . 72.54 109.229 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.572 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.6 p -93.67 108.77 20.96 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.001 0 CA-C-O 121.647 0.736 . . . . 74.12 109.963 174.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 30.8 m -92.84 114.7 27.33 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.59 1.156 . . . . 73.13 109.247 176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.425 ' HB ' HD13 ' A' ' 75' ' ' LEU . 53.3 t -111.93 111.25 35.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 107.082 -1.451 . . . . 74.32 107.082 173.739 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -151.84 138.15 18.46 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 108.487 -0.931 . . . . 73.52 108.487 -172.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 80.24 -176.95 54.54 Favored Glycine 0 C--N 1.347 1.179 0 O-C-N 123.838 0.711 . . . . 75.43 112.736 178.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 87' ' ' ILE . 3.4 pt20 -134.38 160.5 37.77 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.025 0.53 . . . . 71.5 110.626 179.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 65.1 mt -95.99 103.45 15.33 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.161 -0.681 . . . . 65.34 109.161 -179.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -61.78 -28.78 69.7 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 122.739 0.415 . . . . 64.3 111.154 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -152.83 -167.04 14.98 Favored Glycine 0 C--N 1.345 1.03 0 N-CA-C 111.345 -0.702 . . . . 51.11 111.345 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.4 t 59.5 98.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 125.043 1.337 . . . . 72.42 111.106 -176.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.7 t70 . . . . . 0 CA--C 1.547 0.847 0 C-N-CA 123.853 0.861 . . . . 74.15 109.976 -175.989 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 50.1 ttm . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.894 0.378 . . . . 65.41 110.621 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.6 m80 -90.38 99.13 12.21 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 122.916 0.486 . . . . 75.13 110.022 -177.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.1 m-70 -81.1 71.58 8.09 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.199 -1.037 . . . . 73.02 108.199 174.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -83.58 118.45 23.82 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 114.783 -1.099 . . . . 74.24 109.453 -174.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -78.67 167.72 20.81 Favored 'General case' 0 C--O 1.241 0.649 0 C-N-CA 123.57 0.748 . . . . 71.15 110.737 -176.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m170 -73.93 103.96 4.62 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.399 -0.818 . . . . 75.41 108.793 -178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 22.6 p-80 -65.63 -34.62 78.64 Favored 'General case' 0 N--CA 1.481 1.08 0 O-C-N 123.342 0.402 . . . . 65.54 110.029 179.363 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.1 ttt180 -75.36 96.1 3.34 Favored 'General case' 0 C--N 1.35 0.596 0 CA-C-N 115.155 -0.929 . . . . 74.34 108.751 174.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.9 m -139.7 174.13 10.82 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.636 1.174 . . . . 54.24 108.636 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.4 -24.05 67.19 Favored Glycine 0 CA--C 1.533 1.19 0 O-C-N 123.091 0.244 . . . . 71.14 113.261 177.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 30.5 m-20 -76.2 161.08 29.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.107 0.963 . . . . 71.52 112.025 -177.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.5 HG21 HD22 ' A' ' 37' ' ' LEU . 46.3 mt -91.27 107.17 18.4 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 CA-C-N 114.287 -1.324 . . . . 71.04 109.225 177.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.0 tt0 -86.11 130.24 34.59 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 109.113 -0.699 . . . . 73.41 109.113 174.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.2 t -118.95 120.74 64.95 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 107.689 -1.226 . . . . 53.44 107.689 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -133.77 110.25 9.67 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 108.955 -0.757 . . . . 73.03 108.955 177.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 15.9 t-20 -105.49 148.26 27.41 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 108.783 -0.821 . . . . 74.32 108.783 172.545 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 m-80 -144.92 117.66 8.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 124.976 1.31 . . . . 64.44 107.861 174.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.408 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 86.3 m-20 -100.19 132.78 45.36 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 124.051 0.94 . . . . 71.32 109.358 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 6.5 m -95.53 111.2 23.15 Favored 'General case' 0 C--O 1.242 0.687 0 N-CA-C 109.546 -0.539 . . . . 70.34 109.546 -177.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.53 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 71.4 m -153.61 178.96 9.27 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.077 1.351 . . . . 64.24 108.68 -179.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -89.63 64.68 6.67 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.444 -0.947 . . . . 72.03 108.444 172.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -136.6 158.18 23.97 Favored Glycine 0 C--N 1.344 1.004 0 CA-C-N 115.081 -0.963 . . . . 61.43 111.362 -177.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.7 tppt? -60.62 -60.95 2.99 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.48 0.712 . . . . 71.21 112.073 -170.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 81.0 m -153.53 103.22 2.63 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.67 0.788 . . . . 73.51 109.279 178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -112.95 89.93 3.21 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.432 0.693 . . . . 74.3 109.45 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -137.95 152.43 48.95 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.043 -0.725 . . . . 75.42 109.043 172.233 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -132.19 97.58 4.17 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 109.02 -0.733 . . . . 72.34 109.02 -178.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.6 m -108.95 121.14 44.5 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.142 0.577 . . . . 70.0 110.413 -178.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 68.5 m-85 -138.9 153.97 48.32 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.447 1.099 . . . . 65.24 108.897 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 61.7 m -130.39 108.45 9.99 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 109.499 -0.556 . . . . 50.11 109.499 176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.42 HG21 ' HB2' ' A' ' 37' ' ' LEU . 31.1 m -112.27 150.63 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.525 0.73 . . . . 73.12 109.862 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 8.8 t -96.84 -32.51 12.06 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 109.539 -0.541 . . . . 72.24 109.539 172.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 88.4 m -93.09 129.16 39.16 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.767 0.827 . . . . 75.34 110.312 -177.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -71.6 -26.73 62.72 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.887 0.875 . . . . 73.54 111.244 -178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.6 m -69.32 -36.34 76.87 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.903 0.481 . . . . 70.12 111.244 174.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.436 ' O ' HG23 ' A' ' 40' ' ' VAL . 34.2 mm-40 -65.44 -37.16 86.07 Favored 'General case' 0 C--N 1.355 0.844 0 C-N-CA 122.782 0.433 . . . . 74.4 110.321 173.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.5 HD22 HG21 ' A' ' 12' ' ' ILE . 44.6 tp -59.04 -44.62 91.79 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 123.204 0.602 . . . . 74.43 111.056 177.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.446 ' HG2' HD13 ' A' ' 74' ' ' ILE . 91.7 mt-30 -60.27 -39.38 86.64 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.506 0.723 . . . . 54.54 111.04 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt -64.55 -42.4 95.73 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.138 0.975 . . . . 70.13 110.923 176.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 36' ' ' GLU . 69.9 t -67.67 -35.68 73.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 C-N-CA 123.861 0.864 . . . . 72.32 110.835 179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.597 HD21 HD11 ' A' ' 60' ' ' ILE . 86.9 mt -74.02 -33.15 63.66 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.1 0.56 . . . . 71.1 111.068 -179.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -71.54 -34.82 70.37 Favored 'General case' 0 N--CA 1.482 1.136 0 O-C-N 123.485 0.491 . . . . 73.23 110.601 175.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -67.86 -53.63 25.22 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.248 0.619 . . . . 71.15 109.782 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.4 tt -58.48 -33.87 70.26 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 125.707 1.603 . . . . 74.04 111.601 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 35.0 ttpt -59.05 -42.42 90.25 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.406 1.082 . . . . 73.52 111.532 177.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -63.94 -32.76 74.4 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.733 0.813 . . . . 63.05 110.955 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 4.0 m-85 -77.56 -38.85 47.62 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.121 0.969 . . . . 63.34 111.524 -177.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.456 HG23 ' HB2' ' A' ' 53' ' ' CYS . 50.6 mt -74.21 -22.5 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-O 121.563 0.697 . . . . 75.31 110.094 175.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.3 ttpt -77.86 -43.81 29.11 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.714 0.806 . . . . 62.0 110.672 172.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -71.41 -43.57 66.53 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.264 0.625 . . . . 75.23 110.877 -174.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -96.9 113.48 25.02 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 106.995 -1.483 . . . . 72.12 106.995 171.428 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -66.36 77.59 0.13 Allowed Glycine 0 C--N 1.35 1.354 0 O-C-N 124.131 0.894 . . . . 54.12 113.222 -174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.53 ' HA ' ' SG ' ' A' ' 20' ' ' CYS . 57.2 m -81.43 94.68 6.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.716 0.806 . . . . 74.53 109.013 -179.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mtpt -58.58 -31.58 68.16 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.647 0.779 . . . . 74.35 110.908 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -127.44 129.93 48.39 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.154 0.982 . . . . 44.24 108.737 170.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.2 p -138.72 124.72 20.01 Favored 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.896 0.878 . . . . 71.22 108.974 178.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 63.5 ttt-85 -110.09 109.9 20.59 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.024 0.53 . . . . 74.4 109.723 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 32.9 m -109.08 117.04 33.13 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.58 -0.526 . . . . 71.35 109.58 174.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 52.7 p -115.08 121.76 44.06 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.009 0.923 . . . . 70.32 109.494 179.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.597 HD11 HD21 ' A' ' 41' ' ' LEU . 58.9 mt -122.09 145.09 29.35 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.381 1.072 . . . . 73.32 109.615 -177.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 27.8 m -70.47 117.24 11.76 Favored 'General case' 0 C--N 1.349 0.578 0 C-N-CA 122.971 0.508 . . . . 71.41 111.127 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -142.46 78.85 1.64 Allowed 'General case' 0 C--O 1.238 0.45 0 N-CA-C 107.617 -1.253 . . . . 64.51 107.617 175.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 0.8 OUTLIER -75.14 -27.64 59.83 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 115.674 -0.694 . . . . 63.11 111.006 -173.422 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 68.5 p -102.23 162.21 13.1 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.524 0.73 . . . . 52.25 110.652 175.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.415 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 21.5 ptmt -77.48 -29.04 52.47 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.405 0.682 . . . . 73.5 112.611 -170.089 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.51 -42.82 74.21 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 122.779 0.431 . . . . 74.32 110.166 178.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.423 ' OE1' ' HD2' ' A' ' 63' ' ' ARG . 77.2 mt-10 -59.3 -42.51 91.52 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 115.505 -0.77 . . . . 73.54 110.084 172.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.8 72.51 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 115.264 -0.88 . . . . 73.13 111.943 177.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 22.5 mm-40 -67.83 -55.39 13.12 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 123.354 0.409 . . . . 74.22 111.162 178.351 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -70.01 -45.68 66.75 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-N 115.978 -0.556 . . . . 71.23 112.215 -170.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.8 m-30 -66.04 -38.96 89.7 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 122.77 0.428 . . . . 75.32 110.576 -178.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.456 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -62.01 -45.74 92.26 Favored 'General case' 0 C--N 1.354 0.775 0 O-C-N 123.733 0.646 . . . . 74.2 110.631 176.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -57.81 -46.32 84.86 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.103 0.561 . . . . 71.1 110.998 -179.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.446 HD13 ' HG2' ' A' ' 38' ' ' GLN . 60.9 mt -66.29 -41.71 89.53 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.895 0 C-N-CA 123.806 0.842 . . . . 75.55 110.479 -179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 49.6 mt -66.22 -40.45 90.33 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.475 0.71 . . . . 61.13 111.979 -179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.5 mp -62.8 -39.16 83.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.616 0 N-CA-C 109.025 -0.731 . . . . 61.42 109.025 176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 53.5 mtpt -65.1 -40.61 94.79 Favored 'General case' 0 N--CA 1.48 1.067 0 O-C-N 123.687 0.617 . . . . 75.34 112.054 176.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 74' ' ' ILE . 55.3 t -57.16 -50.23 77.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.091 0 C-N-CA 123.434 0.694 . . . . 70.42 110.117 178.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -74.42 -22.53 59.11 Favored 'General case' 0 CA--C 1.551 0.986 0 CA-C-N 115.331 -0.85 . . . . 73.35 111.238 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.15 -33.8 61.55 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 122.948 0.499 . . . . 63.03 111.295 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -71.76 -24.36 61.75 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.015 0.526 . . . . 62.45 110.231 175.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.7 mt -87.71 -25.35 23.5 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.782 0.833 . . . . 54.02 110.587 175.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -140.35 -110.38 0.86 Allowed Glycine 0 C--N 1.352 1.441 0 N-CA-C 112.049 -0.42 . . . . 63.13 112.049 -179.08 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -138.93 171.08 14.86 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.264 1.026 . . . . 74.31 110.051 177.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -75.79 11.49 1.36 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 113.313 0.857 . . . . 74.12 113.313 -173.354 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 101' ' ' GLN . 5.3 m-20 -85.21 25.23 1.01 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.802 0.841 . . . . 72.02 111.795 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 100' ' ' GLY . 26.6 mm -83.41 146.86 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.602 0 C-N-CA 124.175 0.99 . . . . 73.24 109.198 -176.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -130.08 148.81 51.97 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 122.731 0.412 . . . . 63.2 109.953 -177.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 7.6 p -111.14 136.82 46.02 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.581 0 C-N-CA 124.116 0.966 . . . . 65.53 109.693 177.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 57.5 m -98.93 104.28 16.31 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.907 -1.146 . . . . 64.24 107.907 165.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 28.2 t90 -99.46 111.15 23.55 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 107.895 -1.15 . . . . 72.22 107.895 173.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -74.35 -48.3 28.96 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 123.964 0.79 . . . . 74.43 109.974 178.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 161.61 -39.26 0.4 Allowed Glycine 0 C--N 1.34 0.757 0 CA-C-N 115.4 -0.818 . . . . 40.13 111.468 -177.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.482 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 19.7 p-10 -104.25 -23.06 13.28 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.362 1.065 . . . . 62.53 111.161 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 9.3 m -138.79 133.73 32.5 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.058 0.543 . . . . 64.43 110.956 -173.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 9.3 m -92.63 124.55 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 N-CA-C 108.14 -1.059 . . . . 53.13 108.14 166.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 44.5 m -128.97 116.12 18.87 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 109.59 -0.522 . . . . 72.15 109.59 -176.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 97.1 t -109.19 134.78 50.12 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.689 0.796 . . . . 63.03 109.431 178.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -143.84 119.98 10.78 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 107.212 -1.403 . . . . 75.42 107.212 172.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.402 ' O ' HG23 ' A' ' 87' ' ' ILE . . . 60.09 -112.83 4.79 Favored Glycine 0 C--N 1.345 1.073 0 O-C-N 124.062 0.851 . . . . 72.3 113.093 176.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.409 ' HB2' ' O ' ' A' ' 86' ' ' ASP . 16.8 pt20 -158.42 170.1 22.97 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.689 0.796 . . . . 72.1 109.915 -179.144 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 38.4 tp -102.51 110.67 22.69 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.524 -1.287 . . . . 74.43 107.524 165.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -91.78 111.25 22.7 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.291 1.037 . . . . 75.25 109.236 -179.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -99.43 68.21 0.58 Allowed Glycine 0 N--CA 1.475 1.264 0 N-CA-C 111.97 -0.452 . . . . 52.33 111.97 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.4 p -81.55 124.64 39.16 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.052 0 C-N-CA 123.332 0.653 . . . . 64.21 110.552 -179.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 24.7 t70 . . . . . 0 C--O 1.25 1.086 0 C-N-CA 123.77 0.828 . . . . 75.32 109.355 -179.448 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 95.3 mmm . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 121.237 0.541 . . . . 60.0 109.979 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 52.2 m80 -132.77 -68.13 0.61 Allowed 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 106.732 -1.581 . . . . 71.42 106.732 169.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.3 t60 -88.6 90.19 8.3 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 108.098 -1.075 . . . . 54.42 108.098 171.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.7 p80 -74.17 147.52 42.51 Favored 'General case' 0 N--CA 1.48 1.061 0 N-CA-C 109.443 -0.577 . . . . 52.15 109.443 172.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.1 p80 -68.51 120.1 14.02 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 122.944 0.498 . . . . 70.35 111.425 -172.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 50.0 t-80 -160.2 108.88 1.7 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 122.841 0.456 . . . . 53.4 110.801 -175.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -169.78 55.9 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 107.033 -1.469 . . . . 52.24 107.033 173.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -171.87 150.32 2.6 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 114.822 -1.081 . . . . 64.42 109.971 -172.028 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 40.8 p -79.57 152.23 30.21 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.185 0.594 . . . . 71.11 110.129 173.339 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -149.01 167.82 29.44 Favored Glycine 0 C--N 1.341 0.825 0 N-CA-C 111.909 -0.476 . . . . 72.35 111.909 -176.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -77.47 156.34 31.13 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.43 0.692 . . . . 73.33 110.525 -179.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.532 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 41.5 mt -86.08 103.96 13.21 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.916 0 CA-C-N 115.24 -0.891 . . . . 74.1 110.046 -176.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 58.1 tt0 -91.7 139.7 30.43 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 124.282 1.033 . . . . 61.31 109.539 174.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 28' ' ' THR . 39.8 t -123.37 110.51 26.33 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 N-CA-C 107.994 -1.113 . . . . 71.54 107.994 -178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 81.8 mm-40 -102.42 132.06 48.69 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.947 0.899 . . . . 73.31 109.559 175.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.653 HD21 HD11 ' A' ' 44' ' ' LEU . 15.8 m120 -125.34 139.46 53.66 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.662 0.785 . . . . 63.24 109.548 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.574 ' HB3' ' HB3' ' A' ' 57' ' ' ARG . 4.5 t30 -127.2 108.09 10.59 Favored 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 107.799 -1.185 . . . . 71.24 107.799 174.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 82.6 m-20 -107.48 141.87 38.23 Favored 'General case' 0 C--O 1.242 0.696 0 C-N-CA 124.395 1.078 . . . . 74.54 108.168 178.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 67.5 p -121.23 113.9 20.62 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.281 0.562 . . . . 74.24 110.729 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 53' ' ' CYS . 59.8 m -132.26 158.58 41.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 125.355 1.462 . . . . 75.55 108.397 168.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 -58.68 110.32 0.98 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.55 0.74 . . . . 53.12 111.462 -175.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 80.13 -99.0 1.77 Allowed Glycine 0 C--N 1.345 1.044 0 CA-C-N 114.828 -1.078 . . . . 62.43 112.207 -178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.05 135.24 34.12 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 123.696 0.799 . . . . 73.1 110.765 -174.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.1 m -149.73 143.17 25.26 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.747 0.819 . . . . 54.23 109.478 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -92.28 115.34 28.0 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-O 121.155 0.503 . . . . 63.41 110.321 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -90.59 171.43 9.4 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.053 0.941 . . . . 53.43 109.377 175.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.624 ' HE2' ' HG3' ' A' ' 51' ' ' GLN . 91.1 m-85 -131.15 142.53 50.24 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.146 0.578 . . . . 73.42 110.758 -178.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 87.5 m -140.64 129.18 22.73 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.353 -0.98 . . . . 61.52 108.353 169.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -129.34 141.77 50.99 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.737 -0.838 . . . . 75.41 108.737 176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 88.5 m -125.71 106.74 9.93 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 108.733 -0.84 . . . . 74.31 108.733 172.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.531 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 29.5 m -113.42 144.94 20.02 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.465 0 C-N-CA 124.305 1.042 . . . . 72.22 109.421 -177.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.2 t -95.1 -22.01 18.17 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 122.838 0.455 . . . . 74.2 111.651 -173.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.751 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 6.0 m -126.58 156.3 41.1 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.255 0.622 . . . . 61.3 109.324 -176.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -70.79 -30.5 66.99 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.811 0.844 . . . . 53.12 111.583 -176.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.3 p -65.85 -37.01 85.04 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.56 0.744 . . . . 73.11 110.771 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.751 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 13.2 mm-40 -66.49 -34.52 78.12 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.15 -0.932 . . . . 74.01 109.717 177.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD22 HG21 ' A' ' 12' ' ' ILE . 53.7 tp -66.76 -42.27 86.39 Favored 'General case' 0 C--N 1.352 0.715 0 CA-C-N 115.005 -0.998 . . . . 71.13 110.666 176.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -61.79 -30.77 71.03 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.197 0.599 . . . . 64.1 111.567 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.424 ' HE2' ' HA ' ' A' ' 36' ' ' GLU . 55.4 mtmt -75.21 -50.6 15.69 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.234 0.614 . . . . 70.24 110.877 177.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.0 m -65.89 -35.6 75.51 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 CA-C-O 118.539 -0.743 . . . . 71.01 111.565 -175.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.8 mt -71.82 -35.03 69.8 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 123.759 0.662 . . . . 72.33 111.838 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.5 t30 -65.99 -40.15 90.93 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-O 121.473 0.654 . . . . 72.12 109.554 179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -75.7 -36.7 59.95 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 124.888 1.275 . . . . 72.52 110.62 178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.653 HD11 HD21 ' A' ' 16' ' ' ASN . 7.4 tt -66.05 -34.03 77.15 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 125.605 1.562 . . . . 73.1 110.635 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HB2' HG13 ' A' ' 78' ' ' VAL . 34.3 ttpt -60.29 -46.56 89.43 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.406 1.082 . . . . 64.02 110.336 174.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -64.52 -32.59 74.29 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.214 1.006 . . . . 65.52 110.88 -179.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 -74.2 -57.38 3.99 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.559 0.744 . . . . 72.2 111.76 179.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HA ' ' HB2' ' A' ' 51' ' ' GLN . 9.6 mt -65.26 -22.44 31.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 124.573 1.149 . . . . 74.24 111.707 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -52.18 -48.76 64.84 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.831 0.852 . . . . 71.1 110.625 167.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 27.4 ttpp -86.81 -28.9 22.65 Favored 'General case' 0 CA--C 1.553 1.081 0 C-N-CA 124.395 1.078 . . . . 63.05 111.464 -177.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.624 ' HG3' ' HE2' ' A' ' 27' ' ' TYR . 82.6 mm-40 -76.12 -32.66 59.28 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.68 0.792 . . . . 63.12 111.494 179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.67 75.55 2.35 Favored Glycine 0 C--N 1.337 0.596 0 CA-C-N 115.424 -0.807 . . . . 65.12 111.824 -176.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.563 ' SG ' ' SG ' ' A' ' 20' ' ' CYS . 10.5 p -80.05 -55.62 4.82 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 108.747 -0.834 . . . . 75.15 108.747 172.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 49.1 mtmt -88.46 -69.71 0.69 Allowed 'General case' 0 C--N 1.349 0.563 0 CA-C-N 115.82 -0.627 . . . . 64.21 109.393 175.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.448 ' NH2' ' H ' ' A' ' 100' ' ' GLY . 22.8 tpt180 -151.8 156.81 40.97 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 115.919 -0.582 . . . . 65.11 110.121 -172.128 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 74.0 p -138.83 154.6 48.45 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.542 0.737 . . . . 72.32 110.733 178.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.627 ' HE ' ' HG3' ' A' ' 99' ' ' GLU . 24.9 ttm180 -138.89 136.97 36.08 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.889 1.276 . . . . 74.41 108.631 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 63.4 m -138.78 143.04 38.78 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.361 0.664 . . . . 72.11 109.655 174.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 27.1 p -144.95 120.88 10.65 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.256 1.022 . . . . 73.35 109.214 -177.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 60.7 mt -112.08 146.47 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 124.571 1.148 . . . . 71.4 109.241 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.532 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 88.8 m -72.04 121.88 19.95 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-O 121.178 0.513 . . . . 71.04 110.075 176.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.39 93.11 1.94 Allowed 'General case' 0 C--O 1.238 0.477 0 N-CA-C 107.221 -1.4 . . . . 73.34 107.221 178.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.62 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 57.5 mtm-85 -76.29 -70.3 0.45 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 115.577 -0.738 . . . . 75.11 110.395 -168.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 70.6 p -76.94 168.84 19.41 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.008 -0.542 . . . . 72.4 110.626 -174.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt -59.22 -39.16 81.86 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.028 0.931 . . . . 72.44 111.784 -175.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 56.0 mttp -64.77 -49.4 70.87 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.75 0.656 . . . . 52.42 110.167 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -60.36 -42.36 95.63 Favored 'General case' 0 N--CA 1.473 0.709 0 O-C-N 123.861 0.726 . . . . 70.53 110.785 177.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.54 -39.61 91.71 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.395 1.078 . . . . 55.54 111.254 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -69.92 -51.04 36.3 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.862 0.865 . . . . 73.13 110.667 -178.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -77.62 -41.39 38.66 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-N 115.665 -0.698 . . . . 64.44 112.634 -168.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -74.23 -31.13 62.48 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 123.173 0.589 . . . . 72.23 111.244 -178.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.433 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -61.2 -51.21 69.96 Favored 'General case' 0 C--N 1.353 0.724 0 O-C-N 123.893 0.745 . . . . 63.43 109.39 173.4 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -53.67 -42.82 68.31 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 124.151 0.981 . . . . 61.44 112.071 -178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 66.6 mt -59.5 -49.85 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 C-N-CA 123.432 0.693 . . . . 63.35 110.063 176.116 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 25.2 tp -69.05 -25.29 64.39 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.993 -0.549 . . . . 75.41 111.637 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.677 HD11 HG22 ' A' ' 89' ' ' VAL . 1.3 mp -64.55 -45.05 96.69 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 N-CA-C 108.951 -0.759 . . . . 61.24 108.951 173.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.505 ' HD2' HG22 ' A' ' 76' ' ' ILE . 0.8 OUTLIER -68.35 -42.06 79.79 Favored 'General case' 0 N--CA 1.482 1.172 0 O-C-N 123.516 0.51 . . . . 71.32 111.017 178.576 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.467 HG13 ' HB2' ' A' ' 45' ' ' LYS . 76.3 t -56.54 -46.14 82.36 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 C-N-CA 123.563 0.745 . . . . 75.21 110.231 177.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.478 ' HB3' HD12 ' A' ' 87' ' ' ILE . 1.7 m-85 -81.8 -19.03 42.04 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-N 115.623 -0.717 . . . . 73.51 112.501 -178.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -70.81 -38.01 73.27 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.824 -0.436 . . . . 75.15 109.824 175.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 6.5 mm-40 -66.55 -30.46 70.78 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.466 0.707 . . . . 71.03 111.062 176.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 73.8 mt -90.7 -19.31 23.73 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.664 -0.698 . . . . 51.25 111.586 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -162.59 99.66 0.17 Allowed Glycine 0 C--N 1.339 0.726 0 N-CA-C 111.11 -0.796 . . . . 63.34 111.11 -177.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -80.66 6.92 11.37 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.33 0.652 . . . . 70.21 112.2 -176.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -67.42 -84.69 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.732 0.813 . . . . 74.53 110.725 -178.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.614 ' HB2' ' HB3' ' A' ' 101' ' ' GLN . 15.6 m-20 -151.4 130.83 12.91 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 71.31 108.753 -179.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.526 HG21 ' HA ' ' A' ' 76' ' ' ILE . 42.9 mm -115.84 133.16 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 123.554 0.741 . . . . 70.31 109.023 -178.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -118.81 150.22 40.19 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.986 0.915 . . . . 74.53 110.963 -176.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.677 HG22 HD11 ' A' ' 76' ' ' ILE . 21.0 t -107.98 118.83 56.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.546 0.739 . . . . 53.41 109.265 176.571 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 24.1 m -118.47 105.02 11.25 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.956 -0.757 . . . . 64.33 108.956 173.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.9 t90 -99.93 106.45 18.26 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 108.907 -0.775 . . . . 73.23 108.907 -175.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -63.0 -39.91 96.18 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.269 1.028 . . . . 71.32 111.312 178.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 146.92 -50.6 0.59 Allowed Glycine 0 C--N 1.342 0.895 0 N-CA-C 110.689 -0.964 . . . . 73.41 110.689 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.62 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 72.2 m-20 -115.1 11.07 16.29 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.28 0.632 . . . . 62.01 110.319 174.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.5 m -146.82 128.7 15.38 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.012 0.525 . . . . 74.32 111.498 -174.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 13.7 m -99.6 108.69 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 123.672 0.789 . . . . 41.33 109.817 168.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 28.6 m -103.11 132.66 49.2 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 124.43 1.092 . . . . 71.42 110.216 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 80.8 t -115.35 105.17 18.04 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 N-CA-C 108.707 -0.849 . . . . 74.33 108.707 168.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.627 ' HG3' ' HE ' ' A' ' 57' ' ' ARG . 0.7 OUTLIER -153.76 118.68 5.03 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 107.381 -1.34 . . . . 74.0 107.381 170.028 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.448 ' H ' ' NH2' ' A' ' 55' ' ' ARG . . . 128.89 -160.16 22.34 Favored Glycine 0 C--O 1.243 0.666 0 N-CA-C 110.66 -0.976 . . . . 32.22 110.66 -178.517 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.614 ' HB3' ' HB2' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -131.16 143.69 50.81 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.418 -1.327 . . . . 70.41 107.418 175.347 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 33.7 tp -66.22 123.92 21.25 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 108.722 -0.844 . . . . 73.31 108.722 174.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 75.35 -7.53 1.76 Allowed 'General case' 0 CA--C 1.567 1.606 0 C-N-CA 125.345 1.458 . . . . 74.43 111.961 -177.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -94.24 72.76 1.13 Allowed Glycine 0 C--N 1.357 1.717 0 C-N-CA 123.207 0.432 . . . . 63.22 112.318 -176.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 29.2 m -105.57 140.14 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.157 0 C-N-CA 123.651 0.78 . . . . 74.53 109.929 175.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 N--CA 1.481 1.102 0 C-N-CA 122.804 0.442 . . . . 71.12 110.171 -178.064 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 94.0 mmm . . . . . 0 N--CA 1.48 1.067 0 N-CA-C 109.487 -0.56 . . . . 73.44 109.487 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -82.68 141.82 32.16 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.023 0.529 . . . . 72.31 109.574 177.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -55.54 122.0 10.31 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 124.285 1.034 . . . . 73.24 109.615 176.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -46.51 -43.79 17.14 Favored 'General case' 0 N--CA 1.496 1.84 0 C-N-CA 124.452 1.101 . . . . 70.11 112.719 -171.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.3 t-80 61.96 84.29 0.14 Allowed 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.508 1.13 . . . . 63.44 110.222 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -73.52 86.46 1.57 Allowed 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.268 0.556 . . . . 74.32 109.682 179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -78.82 131.28 36.43 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 115.449 -0.796 . . . . 61.33 109.569 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -81.65 75.23 8.6 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 123.584 0.754 . . . . 64.23 109.42 178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.5 t -168.02 178.55 5.05 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.06 -1.427 . . . . 70.23 108.696 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.514 ' H ' ' NH2' ' A' ' 63' ' ' ARG . . . 91.98 -38.95 3.09 Favored Glycine 0 N--CA 1.471 1.015 0 N-CA-C 110.991 -0.844 . . . . 64.21 110.991 -170.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -60.39 149.75 32.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.224 1.41 . . . . 65.14 111.133 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.444 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 40.1 mt -92.43 105.03 16.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 CA-C-N 115.067 -0.97 . . . . 61.21 109.96 -176.212 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 48.6 tt0 -85.64 123.78 31.43 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.403 -0.591 . . . . 61.14 109.403 172.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.413 ' HB ' ' HB2' ' A' ' 29' ' ' TYR . 21.2 t -93.33 127.87 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 N-CA-C 107.898 -1.149 . . . . 75.52 107.898 170.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -133.17 119.06 19.41 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.524 0.73 . . . . 54.32 109.295 -178.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.449 HD21 HD21 ' A' ' 44' ' ' LEU . 13.9 m120 -121.76 139.35 53.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.847 0.859 . . . . 75.3 109.827 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -126.37 139.71 53.06 Favored 'General case' 0 N--CA 1.467 0.376 0 N-CA-C 106.741 -1.578 . . . . 74.12 106.741 175.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -144.01 136.43 26.8 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 109.575 -0.528 . . . . 62.34 109.575 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.8 p -98.81 105.82 18.01 Favored 'General case' 0 C--O 1.241 0.656 0 N-CA-C 108.419 -0.956 . . . . 75.13 108.419 171.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 73.4 m -167.82 -164.44 0.56 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 124.662 1.185 . . . . 62.3 108.918 -169.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -72.58 -33.15 66.56 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.912 0.485 . . . . 60.45 110.587 170.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 71.76 62.78 3.26 Favored Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.644 -0.582 . . . . 62.52 111.644 -179.412 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.03 -40.58 89.81 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.089 0.955 . . . . 72.25 110.763 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 22.9 m -98.15 -88.91 0.31 Allowed 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.831 -0.803 . . . . 74.14 108.831 171.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 t80 -176.3 167.86 2.82 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.886 0.874 . . . . 72.02 109.171 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 26.5 m-20 -66.53 99.23 0.56 Allowed 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 108.349 -0.982 . . . . 74.45 108.349 166.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 47' ' ' TYR . 27.3 m-85 -63.02 108.85 1.31 Allowed 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.579 1.152 . . . . 73.34 111.703 -161.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 m -117.54 120.26 37.52 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 108.814 -0.809 . . . . 73.45 108.814 178.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.413 ' HB2' ' HB ' ' A' ' 14' ' ' VAL . 90.5 m-85 -124.25 153.37 41.76 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.419 1.088 . . . . 65.43 108.979 177.563 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -130.69 106.29 8.38 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 108.31 -0.996 . . . . 55.42 108.31 173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 28.9 m -111.53 147.34 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.97 0.908 . . . . 74.02 108.955 179.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 13.2 t -86.57 -31.49 21.17 Favored 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 122.344 0.258 . . . . 73.24 111.279 -176.041 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 8.8 t -137.92 170.48 15.98 Favored 'General case' 0 C--O 1.246 0.907 0 CA-C-O 121.647 0.737 . . . . 73.1 110.941 -174.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.504 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 35.5 mt-10 -69.84 -32.59 71.07 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-N 114.527 -1.215 . . . . 71.21 112.484 -168.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.9 p -61.85 -43.81 98.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.299 0.64 . . . . 71.33 111.132 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -67.2 -31.42 71.8 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.302 -0.863 . . . . 63.05 111.075 174.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 62.7 tp -65.41 -41.86 93.18 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 122.905 0.482 . . . . 70.32 110.653 173.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.504 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 25.9 mm-40 -63.49 -48.02 79.33 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.196 0.599 . . . . 74.5 111.018 -174.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.29 -42.0 97.91 Favored 'General case' 0 C--N 1.357 0.909 0 O-C-N 124.106 0.879 . . . . 72.54 110.553 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 45.3 t -54.48 -51.23 51.67 Favored 'Isoleucine or valine' 0 C--N 1.365 1.248 0 O-C-N 123.995 0.809 . . . . 62.44 110.181 176.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 96.5 mt -59.04 -26.53 64.66 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 123.985 0.803 . . . . 75.12 113.033 -173.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -71.46 -53.84 12.6 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.777 0.431 . . . . 75.11 111.1 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -63.7 -42.95 97.9 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-O 121.524 0.678 . . . . 72.52 110.365 176.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.449 HD21 HD21 ' A' ' 16' ' ' ASN . 67.9 tp -63.69 -39.76 95.11 Favored 'General case' 0 C--O 1.225 -0.223 0 CA-C-N 114.008 -1.451 . . . . 64.51 110.649 -173.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -55.31 -46.3 76.28 Favored 'General case' 0 N--CA 1.48 1.034 0 O-C-N 123.922 0.763 . . . . 52.54 110.978 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -60.03 -43.45 95.31 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.609 -0.723 . . . . 55.31 110.755 177.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 27' ' ' TYR . 23.0 m-85 -69.5 -33.58 73.05 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.873 0.869 . . . . 63.23 112.547 -178.5 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 91.8 mt -72.38 -37.18 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 123.543 0.737 . . . . 72.42 109.812 -179.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -71.33 -48.94 47.36 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.837 -0.619 . . . . 60.55 110.282 178.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 32.6 ttmt -67.49 -36.24 80.7 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 114.588 -1.187 . . . . 71.05 110.842 -175.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 36.8 mm-40 -109.13 49.31 0.83 Allowed 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 124.15 0.98 . . . . 64.13 108.979 169.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -124.62 56.84 0.68 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 110.637 -0.985 . . . . 72.12 110.637 174.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 59.0 m -60.92 -33.12 72.65 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.864 0.866 . . . . 75.52 110.411 175.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -124.86 -148.94 0.41 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 124.967 1.307 . . . . 71.21 108.027 172.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -95.79 122.12 38.24 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 109.203 -0.665 . . . . 74.51 109.203 -178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.0 m -91.26 152.4 20.52 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 123.728 0.642 . . . . 60.32 110.239 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 49.3 ttt85 -113.48 110.9 21.04 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.782 1.233 . . . . 73.45 109.57 -177.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.4 HG21 HD11 ' A' ' 75' ' ' LEU . 31.8 m -109.57 140.31 43.52 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.566 -0.531 . . . . 74.23 109.566 175.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 59.9 p -144.16 123.38 12.96 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.428 0.691 . . . . 53.33 109.853 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 80.7 mt -110.22 133.01 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 124.64 1.176 . . . . 73.21 108.901 -179.706 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 69.7 m -59.53 118.68 6.33 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.83 0.452 . . . . 63.45 110.862 178.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -163.78 96.64 0.83 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.254 1.022 . . . . 65.04 108.559 -176.173 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.558 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 4.7 ptt-85 -107.15 -38.82 5.89 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.56 1.144 . . . . 73.15 109.913 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 4.8 p -71.67 143.93 49.55 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 115.095 -0.957 . . . . 74.51 109.292 171.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 20.4 ptmt -65.4 -44.26 88.02 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.069 0.948 . . . . 75.52 113.145 -164.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 51.8 mtpt -70.41 -34.32 72.38 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.636 0.374 . . . . 62.33 110.462 -177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -65.08 -41.3 95.16 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.692 0.797 . . . . 74.41 109.857 172.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.41 -33.21 75.43 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.73 0.812 . . . . 75.23 111.088 179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 69.6 mm-40 -71.37 -55.13 8.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.097 0.559 . . . . 74.41 110.892 178.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -74.13 -39.01 63.61 Favored 'General case' 0 N--CA 1.476 0.834 0 CA-C-N 116.114 -0.494 . . . . 61.14 111.905 -168.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.4 m-30 -72.99 -39.01 66.44 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.725 0.41 . . . . 74.34 110.752 -177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.91 84.57 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 123.733 0.646 . . . . 71.34 110.107 177.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -55.03 -48.25 73.65 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.625 0.77 . . . . 64.44 111.434 -179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 71.5 mt -64.53 -36.66 77.96 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 123.575 0.75 . . . . 55.04 110.712 178.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.4 HD11 HG21 ' A' ' 58' ' ' THR . 16.4 tp -76.3 -27.94 56.79 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 122.601 0.36 . . . . 72.14 111.367 -176.118 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.543 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -69.61 -36.92 73.0 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 N-CA-C 108.868 -0.79 . . . . 74.1 108.868 170.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.4 mtpt -61.22 -42.69 99.04 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.237 0.615 . . . . 64.11 111.29 175.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.42 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 79.2 t -56.75 -51.42 67.17 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.093 0 C-N-CA 123.578 0.751 . . . . 62.04 109.56 174.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -68.94 -18.97 64.17 Favored 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.111 -0.949 . . . . 75.24 112.649 179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.505 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -76.67 -34.79 58.23 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.337 0.655 . . . . 45.44 110.502 176.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -79.36 -17.76 53.83 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.32 -0.855 . . . . 72.43 110.631 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 95.9 mt -89.39 -26.63 20.92 Favored 'General case' 0 N--CA 1.483 1.181 0 C-N-CA 123.401 0.68 . . . . 62.13 111.737 176.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -161.79 -101.36 0.16 Allowed Glycine 0 C--N 1.344 1.0 0 C-N-CA 121.72 -0.276 . . . . 51.34 112.722 -175.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.505 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 30.8 m-85 -101.65 148.61 25.04 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.957 0.903 . . . . 72.13 110.161 -170.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 53.5 m-80 -71.26 -27.69 63.62 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 120.852 0.358 . . . . 61.12 110.587 175.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -95.34 114.35 26.12 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 108.845 -0.798 . . . . 74.31 108.845 174.372 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.443 ' HB ' HG13 ' A' ' 76' ' ' ILE . 30.5 mm -129.13 147.98 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.992 . . . . 64.24 109.392 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -89.52 132.43 35.06 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.526 0.73 . . . . 63.23 109.461 177.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.543 ' HB ' HD11 ' A' ' 76' ' ' ILE . 5.3 p -116.34 126.9 74.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.819 0 C-N-CA 124.11 0.964 . . . . 64.51 109.04 176.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.4 m -113.95 109.05 17.88 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 124.671 1.188 . . . . 72.24 108.829 177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 21.2 t90 -82.32 107.94 15.37 Favored 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 109.606 -0.516 . . . . 74.43 109.606 -178.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.3 -34.76 66.79 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.435 1.094 . . . . 60.3 111.397 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 120.87 -43.29 1.55 Allowed Glycine 0 C--N 1.345 1.032 0 N-CA-C 110.958 -0.857 . . . . 74.21 110.958 -177.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 23.1 t70 -100.14 -23.44 14.85 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.668 0.787 . . . . 72.01 110.047 174.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 90.6 m -139.06 142.78 38.18 Favored 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 124.314 1.045 . . . . 51.42 109.739 -172.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 15.7 m -92.94 111.68 24.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 CA-C-O 121.377 0.608 . . . . 74.53 109.917 172.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.5 m -97.2 141.85 29.83 Favored 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 108.855 -0.794 . . . . 63.04 108.855 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 68.7 t -131.03 110.58 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 N-CA-C 108.507 -0.923 . . . . 74.33 108.507 -177.361 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -152.73 138.28 17.74 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.226 0.61 . . . . 74.35 109.817 -177.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 82.53 -170.11 49.97 Favored Glycine 0 C--N 1.353 1.492 0 O-C-N 123.121 0.263 . . . . 60.2 113.181 176.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 14.1 tt0 -118.56 139.87 50.79 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.68 0.792 . . . . 72.12 109.4 176.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 52.1 tp -71.17 102.07 2.43 Favored 'General case' 0 C--N 1.354 0.804 0 C-N-CA 123.287 0.635 . . . . 62.23 109.768 -176.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -59.43 -48.16 82.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.101 0.561 . . . . 71.51 109.515 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 62.33 -158.22 35.47 Favored Glycine 0 C--N 1.35 1.312 0 CA-C-N 115.224 -0.898 . . . . 75.04 113.878 176.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 32.2 m -115.85 162.01 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 C-N-CA 123.813 0.845 . . . . 71.23 109.675 174.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 27.5 t70 . . . . . 0 C--O 1.256 1.404 0 CA-C-O 118.615 -0.707 . . . . 65.42 109.158 -178.747 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 108.893 -0.78 . . . . 62.15 108.893 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.9 m-70 -88.61 96.25 10.57 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.365 0.666 . . . . 75.33 109.486 178.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -127.5 15.26 7.11 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.696 0.798 . . . . 64.52 111.517 -179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -61.87 138.05 58.31 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.299 -0.63 . . . . 75.1 109.299 175.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 40.2 m80 -68.74 81.25 0.28 Allowed 'General case' 0 N--CA 1.478 0.957 0 O-C-N 123.77 0.669 . . . . 71.22 109.502 177.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 52.9 t-80 -78.55 108.79 12.2 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 109.12 -0.696 . . . . 74.3 109.12 178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 64.1 m-70 -119.46 141.55 49.05 Favored 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.98 0.912 . . . . 72.21 109.054 175.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 70.8 ttt180 -165.57 -87.36 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 O-C-N 124.452 1.095 . . . . 71.04 108.974 179.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t 164.54 149.16 0.02 OUTLIER 'General case' 0 C--O 1.245 0.823 0 C-N-CA 125.793 1.637 . . . . 54.4 106.784 -170.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 70.4 9.32 64.3 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 123.059 0.224 . . . . 73.33 113.62 -176.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -65.89 134.05 52.2 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 108.232 -1.025 . . . . 74.42 108.232 171.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.583 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 50.3 mt -68.73 99.27 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 N-CA-C 109.073 -0.714 . . . . 71.34 109.073 -173.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.408 HE21 ' HB2' ' A' ' 15' ' ' GLN . 49.5 tt0 -94.77 123.22 38.09 Favored 'General case' 0 C--O 1.243 0.76 0 CA-C-N 115.344 -0.844 . . . . 74.13 108.841 177.495 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 13.7 t -105.12 106.24 20.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 107.052 -1.462 . . . . 62.21 107.052 172.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.408 ' HB2' HE21 ' A' ' 13' ' ' GLN . 60.3 tt0 -109.91 125.0 52.37 Favored 'General case' 0 C--O 1.236 0.391 0 N-CA-C 108.46 -0.941 . . . . 60.13 108.46 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -106.29 118.09 35.73 Favored 'General case' 0 C--O 1.242 0.672 0 C-N-CA 123.154 0.582 . . . . 65.5 110.273 -178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -102.5 109.36 20.97 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 107.769 -1.197 . . . . 53.23 107.769 177.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.1 p30 -122.81 131.51 53.79 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 108.146 -1.057 . . . . 74.51 108.146 179.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 40.2 p -125.92 109.27 12.28 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.744 0.418 . . . . 73.45 110.085 -175.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' SG ' ' N ' ' A' ' 54' ' ' LYS . 65.6 m -166.56 124.21 1.36 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.099 1.76 . . . . 75.11 107.337 177.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -62.28 101.62 0.24 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.087 0.555 . . . . 73.04 110.747 -177.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 105.19 134.28 7.93 Favored Glycine 0 C--N 1.348 1.214 0 CA-C-N 115.564 -0.744 . . . . 73.35 111.259 -175.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.486 ' HD3' ' HA ' ' A' ' 51' ' ' GLN . 3.7 ttmp? 66.5 32.22 7.52 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 124.576 1.15 . . . . 74.22 110.728 179.425 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.3 m -85.9 69.71 10.58 Favored 'General case' 0 C--O 1.243 0.73 0 CA-C-N 115.201 -0.909 . . . . 63.02 109.625 -179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 14.6 t80 -87.47 110.42 20.3 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 108.262 -1.014 . . . . 72.2 108.262 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.56 56.95 2.49 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 122.05 0.929 . . . . 60.22 110.867 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -53.94 126.91 24.17 Favored 'General case' 0 N--CA 1.48 1.026 0 CA-C-N 114.512 -1.222 . . . . 64.21 111.081 177.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.8 m -137.27 130.26 30.6 Favored 'General case' 0 C--O 1.24 0.572 0 C-N-CA 124.193 0.997 . . . . 63.31 108.915 -176.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -122.79 120.6 34.04 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 123.178 0.591 . . . . 61.24 109.78 -179.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 39.4 m -109.96 105.78 15.06 Favored 'General case' 0 C--O 1.24 0.573 0 N-CA-C 108.256 -1.016 . . . . 73.02 108.256 178.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.489 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.4 m -110.72 147.61 14.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 C-N-CA 124.404 1.082 . . . . 74.45 110.305 -176.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 12.3 t -97.7 -2.82 40.48 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.224 0.61 . . . . 62.3 111.049 -178.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.66 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 11.8 m -140.73 146.59 37.94 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.228 0.611 . . . . 75.43 110.277 -176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -70.3 -22.73 62.81 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.614 1.165 . . . . 74.22 112.451 -177.688 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 26.2 p -67.92 -46.87 70.33 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.768 -0.456 . . . . 74.21 109.768 173.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.66 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 12.1 mm-40 -63.44 -29.89 71.1 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 115.194 -0.912 . . . . 74.34 110.506 178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 60.7 tp -62.98 -50.96 68.72 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.069 0.948 . . . . 52.03 111.346 175.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -64.28 -32.73 74.45 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.847 0.459 . . . . 74.13 111.232 -179.142 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.507 ' HD3' ' HA ' ' A' ' 36' ' ' GLU . 25.5 mtpp -63.52 -53.78 46.48 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 115.1 -0.955 . . . . 52.35 110.443 175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 28.9 m -68.74 -32.06 53.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 CA-C-O 119.264 -0.398 . . . . 74.11 111.971 -175.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 75.0 mt -70.89 -33.19 70.32 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.496 0.718 . . . . 74.34 111.68 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -68.77 -40.87 79.49 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 109.467 -0.568 . . . . 72.42 109.467 176.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -70.06 -34.24 72.95 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 115.19 -0.914 . . . . 71.15 110.29 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.9 tt -69.6 -31.56 69.78 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.973 1.309 . . . . 74.3 110.279 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -61.74 -42.04 98.44 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.741 0.816 . . . . 53.45 110.672 174.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -62.16 -38.42 88.96 Favored 'General case' 0 N--CA 1.481 1.099 0 CA-C-N 115.153 -0.931 . . . . 61.11 110.605 173.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.562 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 21.8 m-85 -63.48 -50.91 67.82 Favored 'General case' 0 C--N 1.352 0.687 0 CA-C-O 118.901 -0.571 . . . . 72.33 111.713 177.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.404 ' HB ' HD13 ' A' ' 82' ' ' LEU . 53.4 mt -60.31 -35.78 64.57 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 CA-C-O 121.125 0.488 . . . . 71.33 109.823 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -66.45 -32.55 73.99 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 115.298 -0.865 . . . . 73.24 111.617 176.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 19.7 ttmm -86.3 -48.38 8.56 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.499 0.72 . . . . 60.24 112.333 -173.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.562 ' HG3' ' O ' ' A' ' 47' ' ' TYR . 0.0 OUTLIER -79.86 -35.63 37.86 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.72 0.408 . . . . 62.34 110.212 -179.412 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 49.56 51.31 28.06 Favored Glycine 0 C--N 1.354 1.578 0 O-C-N 124.484 1.115 . . . . 74.02 114.502 172.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' NE2' ' A' ' 51' ' ' GLN . 83.8 m -71.98 133.12 45.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 116.625 0.213 . . . . 51.5 110.672 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.432 ' N ' ' SG ' ' A' ' 20' ' ' CYS . 27.9 tptp -51.77 -36.97 49.41 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 125.537 1.535 . . . . 63.1 111.684 178.906 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -121.8 120.16 33.78 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 108.147 -1.057 . . . . 71.44 108.147 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.0 p -140.17 139.66 35.75 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.556 0.742 . . . . 71.04 110.831 -176.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 58.7 ttp180 -137.22 146.88 45.37 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.443 1.097 . . . . 75.24 109.45 -176.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.5 ' HB ' HD21 ' A' ' 75' ' ' LEU . 44.2 m -134.56 128.05 32.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 123.67 0.788 . . . . 74.01 109.453 178.178 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.4 m -123.08 120.4 33.18 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 123.868 0.867 . . . . 43.22 109.546 178.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 66.3 mt -110.75 133.12 57.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.825 0.85 . . . . 71.44 108.88 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.583 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 86.3 m -60.12 109.77 1.05 Allowed 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.056 0.542 . . . . 72.31 111.004 -178.853 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -143.08 105.0 4.37 Favored 'General case' 0 C--O 1.232 0.14 0 N-CA-C 107.027 -1.471 . . . . 62.31 107.027 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 93' ' ' GLY . 0.0 OUTLIER -105.18 -26.81 11.91 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.252 0.464 . . . . 75.3 112.252 -175.244 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 63.3 p -92.62 160.41 15.03 Favored 'General case' 0 C--O 1.248 0.998 0 N-CA-C 109.825 -0.435 . . . . 63.5 109.825 171.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 50.6 mtmt -60.26 -37.41 80.35 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.57 0.748 . . . . 63.43 111.003 176.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 6.6 mtpm? -63.6 -44.91 92.59 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.078 0.951 . . . . 73.34 111.333 -177.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -60.0 -44.27 94.64 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.385 -0.825 . . . . 61.41 110.559 173.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.22 -19.04 65.71 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.201 -0.909 . . . . 54.43 112.576 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 55.5 mm-40 -79.41 -58.36 3.25 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.588 0.355 . . . . 75.15 110.807 173.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -75.67 -43.74 45.99 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 112.933 0.716 . . . . 73.33 112.933 -169.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -68.62 -29.0 67.41 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.837 0.455 . . . . 61.33 110.578 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.57 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -61.09 -57.05 14.14 Favored 'General case' 0 C--N 1.354 0.761 0 O-C-N 123.811 0.695 . . . . 71.23 109.989 171.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' HD3' ' A' ' 77' ' ' LYS . . . -49.13 -49.1 43.75 Favored 'General case' 0 N--CA 1.483 1.185 0 O-C-N 124.25 0.969 . . . . 73.52 112.413 -176.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' O ' HG23 ' A' ' 78' ' ' VAL . 59.3 mt -63.05 -42.39 96.45 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.066 0 CA-C-N 115.53 -0.759 . . . . 75.42 110.467 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.5 HD21 ' HB ' ' A' ' 58' ' ' THR . 0.9 OUTLIER -64.36 -37.84 88.92 Favored 'General case' 0 CA--C 1.559 1.312 0 C-N-CA 124.013 0.925 . . . . 75.41 110.336 -179.74 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 89' ' ' VAL . 1.6 mp -60.6 -45.03 97.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 123.778 0.831 . . . . 53.4 109.417 177.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.443 ' HD3' ' O ' ' A' ' 73' ' ' ALA . 0.8 OUTLIER -62.47 -42.16 99.29 Favored 'General case' 0 N--CA 1.481 1.102 0 O-C-N 123.875 0.734 . . . . 60.21 111.243 179.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 74' ' ' ILE . 83.8 t -55.57 -50.17 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 123.929 0.768 . . . . 61.02 110.628 177.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -70.07 -38.86 75.85 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.442 0.697 . . . . 72.24 112.27 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.57 -32.71 71.65 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.193 0.597 . . . . 72.11 111.794 -172.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -72.58 -19.15 61.54 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.476 0.711 . . . . 64.24 111.022 177.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.404 HD13 ' HB ' ' A' ' 48' ' ' ILE . 76.0 mt -100.68 -16.95 17.22 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.118 0.967 . . . . 61.14 111.574 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 142.31 -143.44 12.8 Favored Glycine 0 C--N 1.345 1.031 0 CA-C-O 118.771 -1.016 . . . . 72.54 110.796 178.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 87.7 m-85 41.98 71.24 0.22 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.32 1.448 . . . . 65.23 113.371 170.359 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -82.13 152.34 26.57 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.9 -0.591 . . . . 74.4 109.961 -179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 62.54 86.56 0.11 Allowed 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.423 1.089 . . . . 75.43 108.392 -169.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.431 HG23 HG13 ' A' ' 98' ' ' VAL . 24.0 mm -84.14 138.12 19.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 123.544 0.738 . . . . 62.33 111.551 -171.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -90.79 108.74 20.03 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 108.497 -0.927 . . . . 72.41 108.497 171.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.477 HG22 HD11 ' A' ' 76' ' ' ILE . 24.2 t -94.76 124.44 47.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.839 0 C-N-CA 123.436 0.694 . . . . 74.22 109.167 178.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 49.4 m -123.37 107.85 12.08 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.96 -0.756 . . . . 54.15 108.96 173.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 27.3 t90 -100.05 111.73 24.03 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 108.174 -1.047 . . . . 72.31 108.174 172.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -77.58 -38.17 48.9 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 122.767 0.427 . . . . 72.13 110.746 -179.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . 0.445 ' O ' ' HA ' ' A' ' 63' ' ' ARG . . . 147.25 -38.76 1.08 Allowed Glycine 0 C--N 1.345 1.035 0 CA-C-N 115.343 -0.844 . . . . 72.5 112.065 -176.191 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -94.79 -34.09 12.63 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.033 0.533 . . . . 74.31 111.334 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 73.2 p -135.51 148.3 49.14 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.716 0.407 . . . . 61.12 110.945 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.57 HG21 ' HB2' ' A' ' 72' ' ' ALA . 7.1 p -91.27 114.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 N-CA-C 107.66 -1.237 . . . . 72.31 107.66 165.359 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 62.5 m -109.08 138.63 45.14 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.899 0.879 . . . . 71.03 110.299 -175.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.431 HG13 HG23 ' A' ' 87' ' ' ILE . 35.3 t -124.13 129.43 74.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 108.06 -1.089 . . . . 75.04 108.06 171.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -140.33 119.03 12.39 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 107.561 -1.274 . . . . 71.11 107.561 177.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 59.9 -128.17 45.82 Favored Glycine 0 C--N 1.346 1.107 0 O-C-N 124.532 1.145 . . . . 72.02 113.47 175.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.83 151.42 37.88 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.288 0.566 . . . . 74.31 111.139 -178.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 5.4 tt -75.22 119.84 19.89 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 125.31 1.444 . . . . 75.22 109.459 177.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -70.68 88.4 0.7 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 109.152 -0.684 . . . . 60.21 109.152 172.226 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -153.72 19.18 0.68 Allowed Glycine 0 N--CA 1.468 0.822 0 CA-C-N 114.962 -1.017 . . . . 74.53 111.972 178.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 46.8 t -80.76 92.29 1.94 Allowed 'Isoleucine or valine' 0 C--N 1.349 0.548 0 N-CA-C 108.865 -0.791 . . . . 72.5 108.865 179.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--O 1.247 0.973 0 CA-C-N 115.19 -0.914 . . . . 64.25 108.714 -179.297 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 110.008 -0.367 . . . . 62.3 110.008 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 39.2 m80 -65.99 98.62 0.44 Allowed 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.15 0.58 . . . . 74.44 111.119 -175.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -86.57 125.49 33.83 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.337 0.655 . . . . 73.15 109.688 179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 27.6 m-70 -86.6 -34.25 19.93 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.642 0.734 . . . . 61.44 110.043 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 m80 -126.37 -169.07 1.95 Allowed 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.013 1.325 . . . . 74.31 109.373 177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -124.95 81.82 2.0 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.016 0.926 . . . . 50.02 109.186 174.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m170 73.28 -21.91 0.24 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 125.558 1.543 . . . . 75.14 112.714 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 102.59 12.9 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.211 1.004 . . . . 74.03 109.046 -172.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.8 p -156.9 -78.7 0.08 Allowed 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 123.418 0.687 . . . . 71.31 109.923 174.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.409 ' HA2' ' NH2' ' A' ' 63' ' ' ARG . . . -104.62 21.42 36.76 Favored Glycine 0 C--N 1.357 1.718 0 C-N-CA 123.088 0.375 . . . . 62.51 113.307 -171.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -78.9 121.92 25.46 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.184 0.594 . . . . 64.52 109.789 176.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 58.2 mt -68.35 105.86 1.0 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.596 0 C-N-CA 124.944 1.298 . . . . 71.32 110.55 -177.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 -85.5 138.06 32.47 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.544 0.738 . . . . 72.23 109.6 169.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 28' ' ' THR . 44.5 t -130.37 104.58 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.476 0 N-CA-C 107.882 -1.155 . . . . 73.15 107.882 177.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -108.76 126.77 53.37 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.025 0.93 . . . . 73.11 109.232 -178.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.692 HD21 HD21 ' A' ' 44' ' ' LEU . 16.4 m120 -105.39 112.16 25.15 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 109.308 -0.627 . . . . 54.33 109.308 -179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.6 m-80 -104.66 108.12 19.42 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 108.167 -1.049 . . . . 72.14 108.167 -174.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -100.93 131.21 46.91 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 107.746 -1.205 . . . . 72.12 107.746 179.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.9 m -106.86 110.81 23.07 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.483 -1.302 . . . . 54.32 107.483 175.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 46.6 t -169.06 161.01 10.28 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 123.781 0.832 . . . . 63.13 109.98 -170.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -74.24 139.42 44.33 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.943 0.497 . . . . 72.34 109.926 174.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 96.43 -178.53 34.17 Favored Glycine 0 C--N 1.343 0.925 0 CA-C-N 116.117 -0.492 . . . . 72.44 111.952 -174.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 57.6 tttm -74.93 97.94 3.46 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.424 0.689 . . . . 32.4 109.282 -179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 55.8 p -65.86 107.77 1.93 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.052 0.941 . . . . 62.44 110.589 -178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -69.07 109.15 3.86 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 123.601 0.76 . . . . 73.32 110.625 -179.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -80.45 151.86 29.07 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.735 0.814 . . . . 75.32 110.238 175.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -127.0 109.54 12.01 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.333 -0.988 . . . . 74.01 108.333 174.177 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.462 ' HA ' ' O ' ' A' ' 14' ' ' VAL . 99.1 m -112.54 119.08 36.96 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.148 0.579 . . . . 54.22 109.478 174.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -121.07 140.66 51.65 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.5 0.72 . . . . 75.32 109.189 175.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 91.1 m -125.45 106.74 10.02 Favored 'General case' 0 C--O 1.239 0.542 0 C-N-CA 123.779 0.832 . . . . 71.53 108.87 179.418 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG21 ' HB2' ' A' ' 37' ' ' LEU . 33.1 m -118.59 161.37 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 C-N-CA 124.304 1.042 . . . . 70.33 108.923 178.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.6 t -115.56 -18.56 10.89 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.842 0.457 . . . . 72.33 110.45 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.483 HG22 ' H ' ' A' ' 35' ' ' SER . 29.2 m -116.65 143.63 45.4 Favored 'General case' 0 C--O 1.241 0.607 0 C-N-CA 124.274 1.03 . . . . 73.21 109.084 -176.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.81 -27.76 62.15 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.122 0.569 . . . . 74.53 111.815 -179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.483 ' H ' HG22 ' A' ' 33' ' ' THR . 31.4 m -58.49 -34.2 70.65 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 122.786 0.435 . . . . 70.41 110.844 174.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -70.42 -51.58 28.43 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.379 -0.828 . . . . 72.24 109.878 174.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.442 ' HB2' HG21 ' A' ' 31' ' ' VAL . 53.2 tp -56.79 -43.19 80.64 Favored 'General case' 0 N--CA 1.48 1.031 0 O-C-N 124.586 1.179 . . . . 73.44 112.248 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.6 mm-40 -58.84 -50.36 74.27 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.619 0.768 . . . . 74.34 110.931 -178.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm -60.87 -42.93 98.89 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 123.803 0.689 . . . . 72.12 110.914 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 54.3 t -55.92 -54.02 31.54 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 O-C-N 123.871 0.732 . . . . 73.4 110.761 177.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 94.2 mt -61.07 -26.73 67.85 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 113.868 1.062 . . . . 64.34 113.868 -171.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.6 m-80 -68.33 -54.49 17.01 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 120.881 0.372 . . . . 71.01 110.348 176.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -69.97 -32.95 71.44 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.63 -0.713 . . . . 75.04 111.138 -178.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.692 HD21 HD21 ' A' ' 16' ' ' ASN . 7.8 tt -62.41 -44.59 96.07 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.187 1.395 . . . . 73.4 109.718 178.022 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 36.1 ttpt -54.6 -42.44 71.12 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-N 115.065 -0.97 . . . . 73.54 110.951 173.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -77.19 -26.23 52.64 Favored 'General case' 0 CA--C 1.553 1.072 0 CA-C-N 115.479 -0.782 . . . . 70.34 111.337 -177.247 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -69.62 -38.25 77.15 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.323 0.649 . . . . 74.22 110.655 176.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.42 HD11 ' ND2' ' A' ' 16' ' ' ASN . 64.7 mt -74.32 -39.2 48.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.25 -0.886 . . . . 75.21 109.838 175.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -70.16 -20.53 63.14 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.522 0.729 . . . . 64.53 111.47 -178.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -60.19 -43.95 95.47 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.419 0.688 . . . . 53.11 110.352 174.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.36 175.06 5.7 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 115.431 -0.804 . . . . 72.03 110.637 179.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 175.38 126.67 0.96 Allowed Glycine 0 C--N 1.34 0.786 0 N-CA-C 111.161 -0.775 . . . . 75.52 111.161 -179.633 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 53.9 t -160.09 -51.91 0.05 Allowed 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 108.602 -0.888 . . . . 74.45 108.602 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -139.05 -151.09 0.36 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 124.324 1.049 . . . . 72.33 109.155 172.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 18.7 ttm180 -98.0 159.14 15.13 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.378 0.671 . . . . 73.2 111.552 -166.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.6 p -129.2 154.86 46.36 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.202 1.001 . . . . 60.53 109.954 177.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -131.58 114.9 15.4 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.831 1.253 . . . . 65.53 108.85 176.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 57.1 m -96.46 136.36 37.08 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 108.914 -0.773 . . . . 62.44 108.914 176.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.451 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 51.0 m -124.49 119.71 29.92 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.282 0.633 . . . . 72.3 110.785 -172.476 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 43.9 mt -116.87 138.38 47.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.823 0.849 . . . . 64.4 109.428 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 87.2 m -65.31 116.98 7.19 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.661 0.784 . . . . 74.23 110.97 -179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -164.69 114.03 1.13 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.063 0.945 . . . . 62.03 109.48 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.662 ' HB3' ' HA ' ' A' ' 94' ' ' ASP . 0.0 OUTLIER -117.15 -39.77 3.18 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.553 1.141 . . . . 74.33 110.77 -174.72 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 25.5 p -73.09 141.12 47.56 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 107.772 -1.195 . . . . 72.43 107.772 169.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.432 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 3.0 mppt? -64.97 -34.86 79.44 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.394 0.678 . . . . 73.13 111.271 -171.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.27 -43.17 92.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.74 0.816 . . . . 64.22 111.005 -178.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.418 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 1.2 mp0 -73.83 -32.79 63.86 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 115.442 -0.799 . . . . 55.3 110.262 175.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -68.68 -25.64 64.89 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.426 0.691 . . . . 43.41 111.269 177.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 65' ' ' LYS . 18.8 mm-40 -79.73 -49.61 11.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 123.057 0.543 . . . . 64.41 110.633 174.125 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.418 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 9.8 ptmm? -72.0 -33.17 67.88 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 112.509 0.559 . . . . 73.02 112.509 -169.518 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -81.83 -44.3 17.1 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 122.863 0.465 . . . . 74.25 111.245 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.77 -34.57 78.11 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 115.975 -0.557 . . . . 51.11 111.055 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -54.47 -50.88 66.67 Favored 'General case' 0 N--CA 1.482 1.127 0 O-C-N 123.634 0.584 . . . . 61.43 110.674 177.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 42.1 mt -57.95 -37.85 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.038 0 C-N-CA 123.498 0.719 . . . . 44.5 110.583 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.445 ' HB3' HG21 ' A' ' 98' ' ' VAL . 2.3 mt -72.59 -33.13 66.51 Favored 'General case' 0 CA--C 1.547 0.864 0 CA-C-N 115.452 -0.795 . . . . 75.45 112.269 -178.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.57 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -66.62 -38.65 82.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.917 0 N-CA-C 108.889 -0.782 . . . . 64.41 108.889 173.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -61.56 -44.3 97.29 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 122.624 0.37 . . . . 74.2 110.38 174.66 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 38.2 t -55.04 -54.07 27.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 C-N-CA 123.712 0.805 . . . . 72.24 110.536 176.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 -73.25 -18.03 61.27 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.737 0.815 . . . . 72.33 112.678 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.28 -32.14 49.32 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.893 0.477 . . . . 61.3 110.148 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -73.82 -36.5 64.96 Favored 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.742 0.651 . . . . 70.4 109.76 174.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 83.8 mt -73.97 -26.53 60.52 Favored 'General case' 0 N--CA 1.481 1.082 0 O-C-N 123.931 0.769 . . . . 73.12 110.682 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -109.97 -143.33 9.81 Favored Glycine 0 C--N 1.342 0.873 0 N-CA-C 111.165 -0.774 . . . . 74.45 111.165 176.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -130.15 -59.58 1.04 Allowed 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.588 0.755 . . . . 73.52 109.715 -179.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -153.23 150.22 28.77 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.764 -0.653 . . . . 75.11 110.036 -176.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 33.7 t70 62.1 106.13 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.815 1.246 . . . . 75.54 112.415 175.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.13 135.36 62.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 N-CA-C 108.024 -1.102 . . . . 63.52 108.024 178.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 9.3 p30 -89.17 150.18 22.8 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 120.977 0.418 . . . . 54.14 110.675 -176.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.57 ' HB ' HD11 ' A' ' 76' ' ' ILE . 2.7 p -121.38 108.82 23.27 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 108.59 -0.893 . . . . 62.45 108.59 170.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 56.4 m -94.63 106.51 18.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.36 -0.978 . . . . 63.34 108.36 176.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -79.13 110.53 14.46 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.735 -1.209 . . . . 74.31 107.735 177.709 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -74.42 -36.45 63.44 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.465 0.706 . . . . 72.32 111.07 -176.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 125.77 110.02 1.73 Allowed Glycine 0 C--N 1.344 1.002 0 N-CA-C 109.429 -1.469 . . . . 33.14 109.429 -175.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.662 ' HA ' ' HB3' ' A' ' 63' ' ' ARG . 18.5 t70 76.04 -15.34 0.71 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 125.624 1.569 . . . . 65.45 111.618 -173.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 77.0 m -144.55 133.9 23.12 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.659 1.184 . . . . 71.32 108.166 -176.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.451 ' O ' ' HA ' ' A' ' 59' ' ' SER . 33.7 m -90.29 145.6 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 108.7 -0.852 . . . . 63.41 108.7 174.652 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.9 m -132.01 104.34 6.78 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.559 -0.904 . . . . 72.3 108.559 -177.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.445 HG21 ' HB3' ' A' ' 75' ' ' LEU . 75.7 t -93.93 135.13 29.25 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 C-N-CA 123.507 0.723 . . . . 74.31 109.883 -175.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -138.77 150.24 45.88 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 123.937 0.895 . . . . 74.42 109.976 -171.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -71.18 175.41 39.33 Favored Glycine 0 C--N 1.355 1.587 0 CA-C-N 116.293 -0.412 . . . . 53.3 112.499 167.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.4 mm-40 -103.58 156.87 17.45 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 112.967 0.729 . . . . 74.34 112.967 -170.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.3 mt -66.09 147.59 53.11 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.857 1.263 . . . . 72.42 111.437 178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -80.76 80.82 7.16 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 108.243 -1.021 . . . . 72.32 108.243 168.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -101.49 123.87 8.05 Favored Glycine 0 C--N 1.34 0.781 0 CA-C-N 115.416 -0.811 . . . . 70.42 111.814 -179.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 72.4 t -81.47 87.12 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.039 -0.726 . . . . 74.24 109.039 174.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 28.3 t70 . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 124.36 1.064 . . . . 55.41 110.241 179.288 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.9 ptt? . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 111.692 0.256 . . . . 63.23 111.692 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.8 m80 -74.78 129.64 38.04 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.304 0.642 . . . . 72.13 110.877 -179.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.3 p80 -77.74 83.6 4.1 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 121.544 0.688 . . . . 60.1 109.749 174.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -78.4 76.28 4.91 Favored 'General case' 0 N--CA 1.476 0.875 0 CA-C-O 121.697 0.76 . . . . 73.42 109.729 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 48.5 m80 -147.0 67.3 1.15 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.271 1.028 . . . . 73.53 108.916 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 41.4 t-80 -156.31 114.47 3.33 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.681 0.793 . . . . 74.12 109.883 177.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 51.5 m80 -90.33 174.1 7.76 Favored 'General case' 0 C--O 1.242 0.664 0 C-N-CA 123.642 0.777 . . . . 64.33 110.575 173.258 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.4 tpp180 -75.18 151.05 38.53 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.345 -1.298 . . . . 62.51 109.444 175.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.9 m -109.17 153.48 23.7 Favored 'General case' 0 C--O 1.243 0.761 0 N-CA-C 109.366 -0.605 . . . . 52.22 109.366 171.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.625 ' HA2' ' HD3' ' A' ' 63' ' ' ARG . . . 89.72 -27.14 8.28 Favored Glycine 0 C--N 1.342 0.892 0 CA-C-N 116.03 -0.532 . . . . 62.32 113.505 176.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -63.93 145.28 56.12 Favored 'General case' 0 C--O 1.242 0.687 0 C-N-CA 123.697 0.799 . . . . 70.1 110.799 -175.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.593 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 61.6 mt -80.27 102.41 6.18 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 CA-C-N 115.43 -0.805 . . . . 71.41 110.038 -173.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 53.9 tt0 -96.64 122.04 39.13 Favored 'General case' 0 C--O 1.24 0.596 0 N-CA-C 108.432 -0.951 . . . . 73.1 108.432 173.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 18.2 t -92.35 128.72 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 N-CA-C 107.95 -1.13 . . . . 72.34 107.95 175.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.525 ' HB2' ' HB2' ' A' ' 59' ' ' SER . 95.0 mt-30 -127.34 144.07 51.11 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 107.313 -1.365 . . . . 75.23 107.313 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.8 t-20 -147.34 134.93 20.96 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 120.853 0.358 . . . . 75.05 110.252 174.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.7 t-20 -135.58 120.26 18.31 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 124.983 1.313 . . . . 73.4 108.618 176.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -143.01 159.53 42.06 Favored 'General case' 0 N--CA 1.468 0.433 0 N-CA-C 108.098 -1.075 . . . . 70.44 108.098 167.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 p -116.27 113.65 23.29 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.384 -0.969 . . . . 70.52 108.384 171.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 72.3 m -149.44 -173.89 4.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.246 0.618 . . . . 73.1 111.163 -172.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -68.24 -24.28 64.89 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.625 0.77 . . . . 73.44 112.444 -175.174 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -88.45 127.65 8.7 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 111.254 -0.738 . . . . 45.1 111.254 175.31 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.9 pttm -66.16 -25.48 66.98 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 122.971 0.508 . . . . 63.43 111.301 178.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 76.7 p -85.46 68.07 10.32 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.75 -0.833 . . . . 72.41 108.75 171.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 p90 -94.66 -27.48 15.85 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.107 -0.952 . . . . 74.51 110.421 -178.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -85.95 132.63 34.04 Favored 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.258 -0.883 . . . . 73.25 109.576 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.9 m-85 -132.87 125.85 30.9 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.423 -0.954 . . . . 72.41 108.423 176.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.5 m -136.21 132.27 35.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 109.916 -0.401 . . . . 55.24 109.916 176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 59.3 m-85 -129.74 151.79 49.94 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 107.659 -1.237 . . . . 73.15 107.659 176.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 53.3 m -131.17 105.22 7.54 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.034 -0.728 . . . . 73.13 109.034 175.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.409 HG23 ' HB ' ' A' ' 12' ' ' ILE . 31.4 m -125.85 175.15 8.5 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 124.695 1.198 . . . . 70.33 108.706 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.9 t -129.9 -13.7 4.08 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.957 0.503 . . . . 62.1 110.264 178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 26.6 m -112.04 144.87 40.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.104 0.961 . . . . 64.11 110.24 -175.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -71.51 -29.41 64.76 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.891 0.877 . . . . 73.42 112.182 -175.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 72.8 p -64.2 -44.56 91.58 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 122.833 0.453 . . . . 74.34 110.002 175.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -64.16 -35.33 80.44 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 114.816 -1.084 . . . . 74.23 111.241 176.407 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 12' ' ' ILE . 43.7 tp -61.58 -51.21 69.5 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 122.904 0.482 . . . . 63.24 111.205 174.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -60.54 -43.22 97.44 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.18 0.592 . . . . 74.31 111.859 -175.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -72.53 -32.86 66.45 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.838 0.455 . . . . 74.51 111.835 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.0 -26.32 17.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.385 0 CA-C-N 117.961 0.346 . . . . 62.31 111.04 176.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 76.9 mt -73.22 -32.5 64.79 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.391 0.676 . . . . 73.01 111.258 175.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 -62.87 -48.37 79.29 Favored 'General case' 0 N--CA 1.48 1.043 0 O-C-N 123.649 0.593 . . . . 74.24 110.154 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -66.47 -46.36 76.61 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-N 115.507 -0.769 . . . . 75.15 110.902 179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.0 tt -57.05 -40.55 77.01 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.168 0.987 . . . . 52.52 110.481 177.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -62.12 -48.36 80.47 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.861 0.864 . . . . 73.22 110.509 179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -62.93 -36.37 83.18 Favored 'General case' 0 N--CA 1.481 1.098 0 N-CA-C 112.772 0.656 . . . . 71.1 112.772 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -67.57 -47.71 69.01 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 122.523 0.329 . . . . 64.15 111.809 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.448 HG23 ' SG ' ' A' ' 53' ' ' CYS . 62.4 mt -60.01 -42.74 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 CA-C-N 115.695 -0.684 . . . . 62.43 109.974 174.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -73.42 -20.74 60.65 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.694 1.197 . . . . 72.3 110.913 -176.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.3 tppp? -70.26 -48.31 57.41 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 122.622 0.369 . . . . 71.42 110.155 175.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.614 ' HG3' ' SG ' ' A' ' 53' ' ' CYS . 26.3 pt20 -89.6 -3.16 58.41 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.979 0.512 . . . . 74.34 111.341 178.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 85.97 -63.6 4.2 Favored Glycine 0 C--N 1.346 1.087 0 C-N-CA 123.427 0.537 . . . . 61.54 112.273 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.614 ' SG ' ' HG3' ' A' ' 51' ' ' GLN . 39.6 m 53.68 88.07 0.04 OUTLIER 'General case' 0 C--N 1.359 1.01 0 C-N-CA 125.105 1.362 . . . . 65.22 110.806 -173.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.8 ptpp? -58.0 -33.07 68.53 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 115.462 -0.79 . . . . 63.21 109.999 178.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 5.4 tpp180 -132.43 123.03 25.9 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.074 1.35 . . . . 74.33 108.408 174.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -138.98 154.81 48.32 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.827 0.851 . . . . 64.21 109.363 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 -133.72 116.32 15.62 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.148 0.579 . . . . 73.13 110.364 179.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.7 m -114.78 135.28 54.35 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.419 0.688 . . . . 71.24 109.711 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.525 ' HB2' ' HB2' ' A' ' 15' ' ' GLN . 50.2 m -126.4 121.98 34.01 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.625 1.17 . . . . 74.31 109.696 -176.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.32 136.4 57.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 124.076 0.95 . . . . 63.11 109.625 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.593 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 32.6 m -62.43 108.7 1.17 Allowed 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 121.164 0.506 . . . . 63.35 110.157 173.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -136.51 94.35 3.0 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.783 1.233 . . . . 74.11 108.103 179.051 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.625 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 32.6 mtm-85 -85.28 -62.29 1.57 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.181 0.592 . . . . 72.52 110.245 -169.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 58.6 p -76.83 163.76 26.47 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-N 115.097 -0.956 . . . . 62.45 110.384 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -65.41 -36.97 85.53 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 112.763 0.653 . . . . 74.43 112.763 -168.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 42.0 mtpt -71.52 -37.27 71.22 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 119.521 -0.276 . . . . 75.5 110.534 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -59.46 -45.23 92.23 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.44 0.463 . . . . 61.41 109.966 171.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.4 -36.77 81.21 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 115.052 -0.977 . . . . 54.41 111.449 -178.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -71.14 -54.59 10.51 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 123.024 0.53 . . . . 64.04 111.591 178.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.43 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 21.4 ptmt -74.0 -45.8 47.64 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 112.824 0.676 . . . . 71.05 112.824 -168.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 m-30 -66.63 -36.25 82.12 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.891 0.476 . . . . 64.54 111.189 -176.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.26 -46.19 81.54 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-N 115.474 -0.785 . . . . 30.31 110.189 172.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -59.56 -42.05 91.56 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.301 0.64 . . . . 64.35 111.348 -178.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 70' ' ' LYS . 91.1 mt -58.34 -45.54 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 123.35 0.66 . . . . 71.52 109.462 176.151 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.426 ' HB2' HG21 ' A' ' 98' ' ' VAL . 59.3 mt -67.51 -28.95 68.26 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.523 0.729 . . . . 71.53 112.554 179.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.616 HG13 ' HB ' ' A' ' 87' ' ' ILE . 1.6 mp -67.44 -39.79 83.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 109.443 -0.577 . . . . 72.12 109.443 175.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.442 ' HD2' HG22 ' A' ' 76' ' ' ILE . 1.4 mptm? -73.84 -36.94 64.94 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.997 0.519 . . . . 72.1 111.148 177.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.501 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 44.0 t -57.54 -48.93 82.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.719 0.808 . . . . 70.33 109.031 172.829 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.464 ' HA ' ' HB2' ' A' ' 82' ' ' LEU . 4.7 m-85 -75.28 -21.13 58.73 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.335 1.054 . . . . 65.22 112.377 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.3 -33.39 74.26 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 109.655 -0.498 . . . . 71.21 109.655 173.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -80.99 -36.19 31.03 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 124.038 0.935 . . . . 65.43 111.817 174.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 97.5 mt -72.37 -25.65 61.59 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.455 0.702 . . . . 74.23 111.293 179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -142.16 -87.78 0.11 Allowed Glycine 0 C--N 1.341 0.82 0 N-CA-C 110.905 -0.878 . . . . 74.5 110.905 -177.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 18.8 t80 -170.97 172.49 5.47 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.797 0.839 . . . . 74.33 109.263 -178.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -59.02 164.29 3.05 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 124.321 1.048 . . . . 54.11 112.178 -179.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 67.37 86.42 0.13 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 125.232 1.413 . . . . 75.41 110.184 -176.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.616 ' HB ' HG13 ' A' ' 76' ' ' ILE . 41.7 mm -119.13 139.36 46.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 C-N-CA 123.68 0.792 . . . . 72.31 109.44 -178.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.34 142.98 27.17 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.645 0.778 . . . . 53.25 110.283 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.521 ' HB ' HG22 ' A' ' 98' ' ' VAL . 1.6 p -136.14 125.5 39.15 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 124.383 1.073 . . . . 71.41 109.702 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 17.3 m -104.56 118.95 37.86 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.399 1.08 . . . . 64.44 108.267 170.785 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 35.2 t90 -77.23 100.48 5.84 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-O 121.222 0.534 . . . . 72.14 109.599 176.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -73.11 172.22 11.47 Favored 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 124.064 0.946 . . . . 43.11 109.444 172.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -57.13 101.89 0.18 Allowed Glycine 0 C--N 1.348 1.248 0 CA-C-O 119.569 -0.573 . . . . 71.55 113.102 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 65.1 23.3 12.39 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.776 1.23 . . . . 74.4 111.882 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 91.6 m -146.11 136.78 24.21 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.259 0.624 . . . . 72.32 110.837 -174.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 11.7 m -94.44 110.36 23.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 CA-C-O 121.417 0.627 . . . . 71.3 109.458 169.064 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 88.0 m -102.06 106.23 17.09 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.774 0.83 . . . . 52.11 109.426 178.018 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.521 HG22 ' HB ' ' A' ' 89' ' ' VAL . 74.5 t -101.54 119.34 49.62 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 C-N-CA 124.422 1.089 . . . . 54.33 109.822 -176.474 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -153.38 140.93 19.84 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.524 0.73 . . . . 70.34 110.286 176.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 81.4 -175.32 54.48 Favored Glycine 0 C--N 1.347 1.158 0 O-C-N 123.669 0.605 . . . . 71.43 113.508 171.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -98.55 152.34 19.67 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.582 0.753 . . . . 71.42 109.828 178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 54.2 tp -77.69 109.87 12.06 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 123.167 0.587 . . . . 74.34 111.187 -174.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -78.79 157.86 28.34 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.196 0.998 . . . . 74.31 110.232 172.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -171.69 123.93 1.06 Allowed Glycine 0 C--N 1.343 0.948 0 CA-C-O 119.992 -0.338 . . . . 45.53 112.521 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 27.4 m -83.49 148.93 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.827 0 C-N-CA 123.517 0.727 . . . . 50.34 110.745 179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.248 0.995 0 N-CA-C 108.783 -0.821 . . . . 64.4 108.783 178.471 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.546 0.822 0 CA-C-O 121.561 0.696 . . . . 71.24 109.753 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 25.0 t-80 -87.86 115.76 25.54 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 115.555 -0.748 . . . . 63.23 109.373 178.675 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -95.28 57.77 2.03 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.547 0.739 . . . . 65.23 111.55 -175.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 78.2 m80 53.55 28.17 7.48 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.46 1.104 . . . . 63.03 112.504 177.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -74.38 83.23 1.93 Allowed 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 108.694 -0.854 . . . . 75.31 108.694 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 31.4 t60 -123.28 111.72 16.77 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 124.544 1.137 . . . . 74.35 108.976 -171.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -76.16 99.44 4.69 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.968 -0.753 . . . . 53.53 108.968 173.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -60.28 110.7 1.3 Allowed 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 109.33 -0.618 . . . . 74.15 109.33 176.514 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.1 m -74.93 99.78 3.93 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-N 115.474 -0.785 . . . . 70.13 110.6 -176.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -68.11 -21.96 74.02 Favored Glycine 0 C--N 1.351 1.382 0 CA-C-N 115.478 -0.783 . . . . 64.24 111.538 167.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -67.03 165.17 16.24 Favored 'General case' 0 C--O 1.242 0.702 0 C-N-CA 124.555 1.142 . . . . 73.24 109.905 166.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.45 HG21 HD11 ' A' ' 37' ' ' LEU . 12.5 mt -66.93 101.9 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.058 0 N-CA-C 109.488 -0.56 . . . . 74.22 109.488 -174.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 64.3 tt0 -104.48 124.53 49.43 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-O 121.069 0.461 . . . . 71.43 110.189 179.884 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.436 HG22 HG12 ' A' ' 60' ' ' ILE . 67.6 t -99.14 109.78 25.03 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 C-N-CA 124.502 1.121 . . . . 64.4 109.284 176.63 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -101.61 107.51 18.8 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.524 -0.917 . . . . 73.3 108.524 170.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -102.05 129.94 48.5 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 107.84 -1.17 . . . . 74.32 107.84 176.283 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -120.25 114.0 21.25 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 124.127 0.971 . . . . 72.31 108.459 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -100.03 153.15 19.43 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 107.772 -1.196 . . . . 70.05 107.772 173.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -145.0 125.5 14.02 Favored 'General case' 0 C--O 1.247 0.966 0 CA-C-O 121.118 0.485 . . . . 62.04 109.986 177.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 50.2 t -85.05 -63.45 1.33 Allowed 'General case' 0 C--N 1.343 0.287 0 N-CA-C 107.661 -1.237 . . . . 72.3 107.661 173.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 92.4 m-20 -143.07 -51.59 0.36 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.021 1.328 . . . . 71.15 107.818 173.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -111.96 -143.28 9.03 Favored Glycine 0 CA--C 1.53 0.977 0 CA-C-N 114.886 -1.052 . . . . 72.05 110.901 171.579 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -59.57 135.95 57.83 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.765 0.826 . . . . 71.51 111.338 -177.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 37.8 m -143.46 151.94 40.93 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.693 0.797 . . . . 72.32 109.442 -177.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -59.44 118.13 5.65 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.916 0.886 . . . . 64.33 111.771 -176.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -93.5 158.75 15.55 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.296 1.038 . . . . 55.01 110.496 -177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -121.12 86.37 2.56 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.311 0.644 . . . . 71.03 109.45 179.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.6 m -106.07 126.41 52.17 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.079 0.952 . . . . 70.44 110.578 -177.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -136.46 144.56 44.47 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.181 0.993 . . . . 71.41 109.636 -176.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 65.4 m -109.1 110.64 21.94 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 108.732 -0.84 . . . . 65.21 108.732 169.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.6 m -114.39 147.89 17.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 109.175 -0.676 . . . . 63.41 109.175 176.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.4 t -104.71 -8.53 18.79 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 122.798 0.439 . . . . 74.21 111.266 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 35' ' ' SER . 26.4 m -135.0 150.44 50.33 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 123.337 0.655 . . . . 74.43 110.739 -174.634 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -72.43 -23.55 61.09 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.472 1.109 . . . . 62.31 112.621 -178.135 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.473 ' H ' HG22 ' A' ' 33' ' ' THR . 83.3 p -58.44 -42.33 87.1 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.338 0.589 . . . . 54.22 109.692 173.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 -69.79 -25.97 64.04 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 114.009 -1.451 . . . . 70.4 111.481 -178.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD11 HG21 ' A' ' 12' ' ' ILE . 77.3 mt -62.27 -46.79 87.2 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 110.199 -0.297 . . . . 54.24 110.199 170.704 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -68.77 -34.28 75.31 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 116.652 -0.249 . . . . 71.43 110.907 -178.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 35' ' ' SER . 32.4 mmmt -69.01 -47.77 64.66 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.173 0.589 . . . . 71.12 110.879 178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 55.7 t -73.62 -61.36 1.73 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.537 0.735 . . . . 73.45 111.284 -176.671 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.409 ' HB3' HG21 ' A' ' 78' ' ' VAL . 95.1 mt -58.65 -25.73 63.05 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.19 0.996 . . . . 72.41 113.309 -170.357 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 52.8 t30 -68.8 -43.21 76.13 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.7 0.8 . . . . 55.22 110.851 177.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -76.48 -43.04 41.48 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.903 0.881 . . . . 71.35 110.019 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.0 tt -56.86 -41.44 77.97 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 126.488 1.915 . . . . 72.35 110.332 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.462 ' HB2' HG13 ' A' ' 78' ' ' VAL . 33.7 ttpt -52.67 -45.52 66.8 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.887 1.675 . . . . 64.4 112.546 175.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -70.09 -28.95 65.83 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.029 0.931 . . . . 72.11 110.747 -177.052 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 59.4 m-85 -74.35 -37.02 63.64 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.203 0.601 . . . . 72.15 111.666 174.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 74.1 mt -62.07 -43.63 97.95 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 N-CA-C 109.359 -0.608 . . . . 73.03 109.359 175.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -55.13 -39.67 69.7 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 114.993 -1.003 . . . . 73.12 111.457 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.5 ttpp -86.84 -13.02 46.19 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.858 0.863 . . . . 74.31 112.102 -175.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -127.5 25.69 6.05 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.602 0.761 . . . . 63.53 111.313 175.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -86.48 71.24 2.83 Favored Glycine 0 C--N 1.344 1.006 0 CA-C-N 116.083 -0.508 . . . . 63.1 112.612 -179.235 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 55.7 m -72.26 -64.88 0.86 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 122.972 0.509 . . . . 61.22 110.053 176.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -93.73 -93.28 0.17 Allowed 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 108.274 -1.01 . . . . 61.31 108.274 175.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.401 HH22 HD13 ' A' ' 87' ' ' ILE . 0.0 OUTLIER -154.97 155.9 35.06 Favored 'General case' 0 C--N 1.355 0.809 0 N-CA-C 107.851 -1.166 . . . . 75.01 107.851 172.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.3 p -90.49 146.1 24.38 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 122.806 0.442 . . . . 62.32 110.012 171.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -111.27 110.78 21.43 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 107.443 -1.317 . . . . 53.54 107.443 166.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 15.4 m -106.47 138.65 42.26 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 108.798 -0.816 . . . . 72.22 108.798 173.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 25.3 p -133.48 119.18 19.24 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 108.805 -0.813 . . . . 64.53 108.805 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.436 HG12 HG22 ' A' ' 14' ' ' VAL . 58.3 mt -110.26 136.77 45.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.007 0.923 . . . . 62.41 109.307 -176.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.2 m -61.56 118.1 6.61 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.24 0.616 . . . . 72.45 110.525 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -157.8 96.82 1.52 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 124.895 1.278 . . . . 52.24 108.193 -175.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 7.9 ptm180 -99.61 -26.46 14.07 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.368 0.877 . . . . 74.4 113.368 -169.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 65.8 p -96.58 163.92 12.82 Favored 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 109.932 -0.395 . . . . 62.55 109.932 173.234 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -60.01 -35.25 74.65 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.803 0.841 . . . . 62.12 111.212 177.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -65.61 -47.23 76.35 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.599 0.76 . . . . 73.03 110.46 -178.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.432 ' HA ' ' HG2' ' A' ' 70' ' ' LYS . 53.0 mt-10 -65.23 -35.39 80.89 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 124.144 0.903 . . . . 63.43 111.307 176.715 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -67.49 -21.15 65.52 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.141 -0.936 . . . . 62.41 112.155 178.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -85.39 -58.57 2.62 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.57 0.748 . . . . 74.3 110.281 174.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.432 ' HG2' ' HA ' ' A' ' 67' ' ' GLU . 0.0 OUTLIER -69.19 -46.96 66.2 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.881 0.872 . . . . 60.5 113.049 -167.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 21.3 m-30 -73.69 -36.89 65.33 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.104 0.561 . . . . 64.41 110.965 -177.257 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -67.42 -36.31 81.0 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-N 115.074 -0.966 . . . . 55.02 110.82 176.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.4 -44.36 97.27 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.612 0.57 . . . . 50.34 111.254 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.73 -37.16 75.24 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.103 0 C-N-CA 124.148 0.979 . . . . 33.54 110.083 176.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.411 HD22 HG13 ' A' ' 60' ' ' ILE . 21.2 tp -80.61 -28.44 37.03 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 123.344 0.657 . . . . 75.24 111.854 -177.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.476 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.5 mp -64.91 -40.09 87.88 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 N-CA-C 108.339 -0.985 . . . . 74.23 108.339 173.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 54.3 mtpt -58.79 -46.42 87.59 Favored 'General case' 0 C--N 1.357 0.927 0 O-C-N 124.117 0.886 . . . . 74.41 111.282 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.462 HG13 ' HB2' ' A' ' 45' ' ' LYS . 89.2 t -53.7 -48.89 59.86 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 123.903 0.881 . . . . 52.1 110.686 178.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . 0.484 ' HB3' HD12 ' A' ' 87' ' ' ILE . 18.2 m-85 -75.49 -25.25 57.16 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 114.897 -1.047 . . . . 71.22 112.681 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -78.59 -39.22 38.06 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.051 0.541 . . . . 51.5 111.078 -176.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -67.07 -34.56 77.92 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.824 0.85 . . . . 74.55 110.65 178.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 87.7 mt -77.08 -30.31 55.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.169 -0.468 . . . . 71.13 110.336 172.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 51.84 -120.09 9.94 Favored Glycine 0 C--N 1.348 1.224 0 O-C-N 124.11 0.881 . . . . 71.42 113.44 -179.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 48.7 t80 67.7 -78.52 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 125.669 1.588 . . . . 63.23 111.649 174.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -98.17 171.29 8.32 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.229 0.612 . . . . 74.34 109.568 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -55.19 156.25 4.27 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 125.162 1.385 . . . . 75.11 112.34 178.171 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.484 HD12 ' HB3' ' A' ' 79' ' ' TYR . 19.0 mm -113.33 107.51 23.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 N-CA-C 107.71 -1.219 . . . . 73.3 107.71 177.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -122.13 128.07 50.84 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 108.974 -0.75 . . . . 62.2 108.974 -176.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.476 ' HB ' HD11 ' A' ' 76' ' ' ILE . 3.9 p -117.96 118.86 59.67 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.032 0 C-N-CA 123.547 0.739 . . . . 54.24 110.128 179.678 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 14.1 m -114.64 108.74 17.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.583 1.153 . . . . 74.2 109.157 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 20.0 t90 -76.18 107.13 8.19 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 108.966 -0.753 . . . . 71.25 108.966 175.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -68.2 -22.79 64.79 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.584 1.154 . . . . 73.44 111.418 178.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 122.08 -56.14 0.65 Allowed Glycine 0 C--N 1.344 1.014 0 N-CA-C 110.396 -1.081 . . . . 73.01 110.396 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -100.66 -5.74 26.17 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.016 0.926 . . . . 75.23 110.113 176.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 3.6 m -145.22 151.34 38.25 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 123.492 0.717 . . . . 75.44 110.301 -173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 6.8 m -112.24 111.67 37.14 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 123.51 0.724 . . . . 62.25 110.03 169.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 40.8 m -87.98 130.74 34.86 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 124.038 0.935 . . . . 62.12 109.52 174.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 49.6 t -127.92 120.93 55.12 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 N-CA-C 108.306 -0.998 . . . . 73.13 108.306 170.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -151.66 169.46 22.11 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.301 1.44 . . . . 75.43 107.379 176.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.62 -144.03 0.93 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.554 -0.355 . . . . 61.02 113.166 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -74.44 108.78 7.42 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.567 -0.531 . . . . 64.43 109.567 176.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 106' ' ' ASP . 46.5 tp -67.8 126.58 29.87 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.358 -0.979 . . . . 51.31 108.358 172.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -62.68 -52.35 63.64 Favored 'General case' 0 N--CA 1.476 0.863 0 O-C-N 123.958 0.786 . . . . 65.42 111.285 -172.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -71.75 -21.85 78.82 Favored Glycine 0 C--N 1.35 1.346 0 CA-C-O 119.564 -0.576 . . . . 60.01 113.395 -179.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 57.8 t 63.07 99.55 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.363 1.161 0 C-N-CA 125.171 1.389 . . . . 64.35 111.453 178.216 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.416 ' H ' HD23 ' A' ' 102' ' ' LEU . 36.9 t70 . . . . . 0 C--O 1.251 1.147 0 C-N-CA 123.854 0.862 . . . . 75.11 109.618 -179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.8 ttt . . . . . 0 N--CA 1.479 1.018 0 CA-C-O 121.035 0.445 . . . . 72.34 110.171 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.1 p80 177.81 151.03 0.22 Allowed 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 125.205 1.402 . . . . 75.34 109.136 172.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -67.3 94.65 0.39 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.096 -0.705 . . . . 73.42 109.096 172.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.7 p-80 -73.89 110.2 7.99 Favored 'General case' 0 C--N 1.351 0.634 0 N-CA-C 108.658 -0.868 . . . . 62.53 108.658 176.29 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 2.4 p-80 -91.36 160.36 15.52 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 115.658 -0.701 . . . . 60.31 109.67 173.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -72.19 80.42 0.98 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.261 0.553 . . . . 73.44 110.636 -178.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 42.6 t60 -163.28 130.32 3.45 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 124.827 1.251 . . . . 55.43 107.765 177.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -92.81 133.89 35.61 Favored 'General case' 0 C--O 1.235 0.303 0 N-CA-C 109.217 -0.661 . . . . 75.12 109.217 179.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 38.3 t -100.0 27.24 5.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 123.937 0.895 . . . . 71.21 110.054 176.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 64.73 50.03 60.78 Favored Glycine 0 C--N 1.35 1.348 0 N-CA-C 110.081 -1.208 . . . . 73.44 110.081 -169.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -73.22 159.12 33.94 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 123.938 0.895 . . . . 73.22 111.925 -166.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.571 ' HA ' ' HB ' ' A' ' 61' ' ' THR . 20.2 mt -83.86 102.87 10.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.694 0 CA-C-N 114.871 -1.059 . . . . 65.55 109.503 -176.136 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 39.6 tt0 -80.76 103.74 10.81 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.159 -1.052 . . . . 63.1 108.159 170.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 51.2 t -92.93 105.0 16.3 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 N-CA-C 107.383 -1.34 . . . . 64.41 107.383 172.89 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -124.02 116.68 23.22 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 123.423 0.689 . . . . 65.53 109.275 -178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.508 ' HB2' HD21 ' A' ' 44' ' ' LEU . 18.6 t-20 -103.76 113.95 27.85 Favored 'General case' 0 CA--C 1.535 0.367 0 N-CA-C 108.744 -0.836 . . . . 55.1 108.744 179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.7 t-20 -101.75 118.58 37.23 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 107.457 -1.312 . . . . 63.44 107.457 -177.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' ND2' ' SG ' ' A' ' 53' ' ' CYS . 85.2 m-20 -116.9 125.73 51.93 Favored 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 109.213 -0.662 . . . . 72.01 109.213 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.517 ' HB ' ' HB3' ' A' ' 55' ' ' ARG . 20.0 m -92.5 109.14 20.53 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.534 -0.913 . . . . 72.53 108.534 -179.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.454 ' HB3' ' H ' ' A' ' 54' ' ' LYS . 26.3 p -168.28 165.57 12.92 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 125.184 1.394 . . . . 71.51 108.486 179.027 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.51 98.9 1.18 Allowed 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 108.926 -0.768 . . . . 64.23 108.926 176.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -139.9 158.5 25.73 Favored Glycine 0 C--N 1.343 0.948 0 CA-C-N 115.7 -0.682 . . . . 54.14 112.011 -176.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -83.19 -76.97 0.26 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 122.981 0.513 . . . . 54.41 110.05 -172.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.8 p -144.06 97.51 3.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.366 1.066 . . . . 71.13 109.471 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 35.7 p90 -110.43 128.29 55.52 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 109.375 -0.602 . . . . 74.24 109.375 177.607 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -85.44 -70.43 0.59 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.699 -0.852 . . . . 75.1 108.699 175.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 55.13 19.24 2.72 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 124.242 1.017 . . . . 75.13 112.055 -175.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 35.8 m -107.55 124.95 50.68 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 124.74 1.216 . . . . 72.34 108.692 179.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 40.5 m-85 -136.99 121.31 18.08 Favored 'General case' 0 N--CA 1.467 0.378 0 N-CA-C 107.635 -1.246 . . . . 73.24 107.635 -178.65 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.7 m -96.6 105.1 17.14 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 108.416 -0.957 . . . . 53.31 108.416 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.425 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 34.2 m -110.25 132.3 58.94 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 124.252 1.021 . . . . 61.43 109.442 -176.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.7 t -99.01 8.35 45.09 Favored 'General case' 0 N--CA 1.482 1.126 0 CA-C-O 121.398 0.618 . . . . 63.43 110.706 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.593 HG22 ' H ' ' A' ' 35' ' ' SER . 31.7 m -149.7 147.28 27.88 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.01 0.924 . . . . 74.02 110.049 -176.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -70.92 -27.99 64.19 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.397 0.679 . . . . 51.22 111.795 178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.593 ' H ' HG22 ' A' ' 33' ' ' THR . 13.8 m -57.02 -39.88 75.6 Favored 'General case' 0 N--CA 1.483 1.218 0 CA-C-O 121.26 0.553 . . . . 55.32 110.436 172.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.464 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 22.4 mm-40 -76.03 -31.78 59.04 Favored 'General case' 0 C--N 1.348 0.512 0 CA-C-N 114.492 -1.231 . . . . 64.45 111.087 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.461 HD12 HG21 ' A' ' 12' ' ' ILE . 6.8 tt -69.65 -43.46 72.55 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.834 0.854 . . . . 62.24 110.835 178.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 19.0 mm-40 -66.12 -46.34 77.9 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.715 0.806 . . . . 72.34 111.333 -175.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.43 -36.91 85.35 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 115.505 -0.77 . . . . 54.21 111.324 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.2 p -84.1 -27.1 7.2 Favored 'Isoleucine or valine' 0 C--N 1.353 0.754 0 CA-C-N 116.604 -0.271 . . . . 74.0 111.055 -173.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 43.5 mt -73.71 -28.74 61.88 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.019 0.528 . . . . 73.25 110.605 171.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -70.08 -41.7 73.74 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 109.236 -0.653 . . . . 65.23 109.236 175.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 38.5 mm-40 -62.69 -50.12 72.4 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.057 0.543 . . . . 72.03 110.529 173.249 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.508 HD21 ' HB2' ' A' ' 16' ' ' ASN . 58.1 tp -58.17 -37.8 75.42 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.808 1.243 . . . . 61.32 111.489 -176.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -55.34 -36.23 66.05 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.58 1.152 . . . . 71.43 111.341 -179.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -68.64 -45.4 71.92 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.811 0.844 . . . . 73.12 111.351 177.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.522 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 96.9 m-85 -61.56 -36.16 79.83 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.247 0.619 . . . . 74.11 111.89 -178.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -74.93 -43.97 45.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.13 0 CA-C-N 115.724 -0.671 . . . . 70.14 109.808 176.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -63.1 -24.88 68.1 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.411 1.084 . . . . 74.41 111.893 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.522 ' HE2' ' HA ' ' A' ' 47' ' ' TYR . 19.8 ttmm -60.24 -17.34 41.09 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.894 1.278 . . . . 64.35 112.28 -175.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 73.91 13.62 4.15 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 125.067 1.347 . . . . 73.43 112.303 174.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -77.96 -26.6 59.97 Favored Glycine 0 C--N 1.345 1.069 0 N-CA-C 111.47 -0.652 . . . . 62.11 111.47 168.153 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.413 ' SG ' ' ND2' ' A' ' 18' ' ' ASN . 27.7 m -83.13 98.23 9.22 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.411 1.085 . . . . 74.22 109.964 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.454 ' H ' ' HB3' ' A' ' 20' ' ' CYS . 88.7 tttt -61.67 -53.84 50.71 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.268 0.627 . . . . 72.35 110.551 -178.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.517 ' HB3' ' HB ' ' A' ' 19' ' ' THR . 1.7 tpm_? -112.46 144.82 41.28 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 106.838 -1.541 . . . . 71.32 106.838 166.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 71.3 p -132.84 131.89 41.52 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 120.875 0.369 . . . . 60.32 111.2 -177.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -135.68 130.12 33.79 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 125.052 1.341 . . . . 64.05 108.233 179.692 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.411 ' HB ' HD11 ' A' ' 75' ' ' LEU . 6.0 m -118.44 126.37 51.92 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 108.881 -0.785 . . . . 41.54 108.881 170.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 38.7 m -115.66 118.72 33.88 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 108.525 -0.917 . . . . 54.23 108.525 177.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 70.8 mt -113.79 126.96 71.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.903 0.881 . . . . 72.21 108.806 -179.091 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.571 ' HB ' ' HA ' ' A' ' 12' ' ' ILE . 73.8 m -63.13 115.32 4.37 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-O 121.312 0.577 . . . . 50.1 110.81 178.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.481 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -140.45 80.71 1.77 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.725 1.21 . . . . 62.12 107.902 -176.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.622 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.2 ptm180 -78.79 -30.95 45.82 Favored 'General case' 0 N--CA 1.475 0.808 0 CA-C-N 114.612 -1.177 . . . . 64.41 112.392 -171.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 1.4 p -99.25 153.11 19.2 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.542 1.137 . . . . 72.24 110.119 177.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.472 ' HG2' ' HH2' ' A' ' 91' ' ' TRP . 36.8 mtmm -67.09 -43.42 82.61 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.408 0.683 . . . . 74.24 112.03 -171.307 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -64.24 -39.96 95.04 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.171 0.588 . . . . 73.33 110.956 179.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -67.57 -34.93 78.03 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 114.953 -1.021 . . . . 73.31 110.676 176.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.481 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -62.83 -37.86 88.46 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.212 0.605 . . . . 75.03 110.936 177.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -73.23 -44.11 60.08 Favored 'General case' 0 N--CA 1.474 0.735 0 O-C-N 123.861 0.725 . . . . 62.23 111.305 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 7.3 ptmm? -78.31 -30.5 48.32 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 116.338 -0.392 . . . . 70.14 111.814 -171.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 m-30 -81.32 -35.07 31.42 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.009 0.524 . . . . 73.34 110.621 177.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.494 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -60.42 -45.46 93.53 Favored 'General case' 0 C--O 1.214 -0.771 0 O-C-N 123.85 0.719 . . . . 74.15 109.928 172.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.41 ' O ' ' HG3' ' A' ' 77' ' ' LYS . . . -53.93 -49.09 69.44 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.291 0.636 . . . . 74.05 111.276 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.38 -47.32 91.01 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 O-C-N 124.028 0.83 . . . . 52.11 110.72 177.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.411 HD11 ' HB ' ' A' ' 58' ' ' THR . 18.2 tp -70.25 -31.42 68.81 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 115.613 -0.722 . . . . 72.34 111.828 -173.039 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.536 HD11 HG22 ' A' ' 89' ' ' VAL . 1.5 mp -69.11 -37.81 77.24 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.709 0 C-N-CA 123.969 0.908 . . . . 61.04 108.842 175.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HG3' ' O ' ' A' ' 73' ' ' ALA . 60.0 mtpt -66.09 -39.98 90.43 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 122.971 0.509 . . . . 74.13 111.917 175.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.415 ' O ' ' HG ' ' A' ' 82' ' ' LEU . 90.9 t -58.13 -55.86 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 C-N-CA 123.563 0.745 . . . . 71.44 109.325 176.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -65.51 -25.48 67.49 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 114.86 -1.064 . . . . 72.33 112.535 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -69.45 -39.42 77.8 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.926 0.49 . . . . 62.21 110.589 176.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -73.67 -28.43 61.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.24 0.616 . . . . 72.13 111.128 176.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.415 ' HG ' ' O ' ' A' ' 78' ' ' VAL . 91.3 mt -83.87 -25.15 30.49 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.132 0.573 . . . . 61.14 112.082 -179.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -155.75 -103.22 0.21 Allowed Glycine 0 C--N 1.345 1.035 0 N-CA-C 111.898 -0.481 . . . . 64.02 111.898 -176.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -129.69 168.6 16.25 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.627 0.771 . . . . 74.01 110.932 -173.604 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -83.34 -14.55 52.64 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.648 0.779 . . . . 70.31 111.153 177.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.28 100.94 0.67 Allowed 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.522 -0.918 . . . . 62.12 108.522 169.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 47.5 mm -129.17 136.55 59.28 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.18 0 C-N-CA 123.378 0.671 . . . . 75.13 110.951 -172.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -88.45 110.32 20.74 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.426 -0.953 . . . . 62.01 108.426 171.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.536 HG22 HD11 ' A' ' 76' ' ' ILE . 10.9 t -102.05 111.77 32.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.739 0.816 . . . . 61.13 108.972 179.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 99.9 m -112.76 109.64 19.26 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.067 0.947 . . . . 62.14 109.358 176.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . 0.472 ' HH2' ' HG2' ' A' ' 65' ' ' LYS . 21.5 t90 -95.82 112.75 24.4 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 108.309 -0.997 . . . . 73.52 108.309 173.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -74.98 -35.35 62.05 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.346 1.058 . . . . 75.02 111.832 179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 142.41 -62.13 0.52 Allowed Glycine 0 C--N 1.347 1.179 0 N-CA-C 111.469 -0.652 . . . . 40.13 111.469 -178.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.622 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 6.6 m-20 -97.23 -6.26 35.04 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.463 0.705 . . . . 75.12 110.929 174.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 33.6 m -144.37 139.76 28.65 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 123.942 0.897 . . . . 74.11 110.175 -178.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.3 p -105.03 109.28 27.17 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 CA-C-O 121.721 0.772 . . . . 40.25 109.436 168.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 99.0 m -95.24 133.37 39.19 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.628 1.171 . . . . 54.03 110.895 177.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 51.8 t -125.53 129.42 72.82 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.561 1.144 . . . . 73.13 108.324 170.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -148.42 140.65 24.13 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.739 0.816 . . . . 63.25 109.315 177.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 68.18 -126.52 23.05 Favored Glycine 0 C--N 1.345 1.041 0 O-C-N 123.794 0.684 . . . . 71.14 111.943 179.143 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -161.12 168.63 23.95 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.053 0.541 . . . . 72.42 110.71 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 6.9 tt -78.57 123.3 26.95 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.179 -1.415 . . . . 52.13 107.179 171.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -72.95 -63.73 1.11 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 123.202 0.601 . . . . 74.31 110.196 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 124.32 -155.08 18.03 Favored Glycine 0 C--O 1.246 0.854 0 N-CA-C 110.52 -1.032 . . . . 42.0 110.52 -173.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 20.1 t 50.42 59.37 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.988 0 C-N-CA 124.329 1.052 . . . . 75.21 109.156 -174.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 . . . . . 0 C--O 1.246 0.897 0 CA-C-N 114.919 -1.037 . . . . 74.05 109.696 -174.813 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.513 -0.551 . . . . 72.53 109.513 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.99 58.26 1.54 Allowed 'General case' 0 N--CA 1.48 1.075 0 CA-C-O 122.326 1.06 . . . . 73.12 111.052 -176.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -101.73 -52.7 3.14 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 108.471 -0.936 . . . . 71.13 108.471 168.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.6 t60 57.51 33.85 23.81 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.445 1.098 . . . . 74.31 112.077 167.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 93.6 m-70 51.77 66.52 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.407 1.083 . . . . 73.2 110.926 178.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.2 p-80 -82.04 45.14 0.9 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.051 0.94 . . . . 54.43 110.612 -178.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -72.51 86.62 1.17 Allowed 'General case' 0 C--O 1.241 0.654 0 C-N-CA 124.533 1.133 . . . . 61.14 109.277 -176.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 27.9 mmt180 -68.59 134.34 49.82 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 114.87 -1.059 . . . . 71.12 110.016 178.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 23.1 t -162.95 91.2 0.72 Allowed 'General case' 0 C--O 1.24 0.569 0 N-CA-C 107.592 -1.262 . . . . 73.5 107.592 178.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -78.09 167.8 53.66 Favored Glycine 0 C--N 1.344 0.973 0 CA-C-N 115.572 -0.74 . . . . 54.22 112.703 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -69.38 159.8 32.51 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.232 1.013 . . . . 63.03 111.476 -177.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 25.6 mt -76.57 100.0 2.26 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 CA-C-N 115.343 -0.844 . . . . 74.03 109.337 -174.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 24.9 tt0 -95.29 113.39 25.06 Favored 'General case' 0 C--O 1.243 0.75 0 N-CA-C 108.604 -0.887 . . . . 75.42 108.604 176.52 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 8.3 t -101.72 107.27 21.2 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 C-N-CA 124.46 1.104 . . . . 54.24 108.226 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 22.2 tm0? -116.86 119.04 34.15 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 108.219 -1.03 . . . . 72.2 108.219 178.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -106.22 148.65 27.68 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.246 0.618 . . . . 75.34 109.656 -179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.03 110.44 12.95 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.12 -1.067 . . . . 65.54 108.12 -177.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 8.2 m-20 -101.97 117.7 35.37 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 109.131 -0.692 . . . . 74.43 109.131 175.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.4 m -99.95 111.46 23.76 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 123.459 0.704 . . . . 74.04 110.743 -174.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 53' ' ' CYS . 79.0 m -133.75 -68.88 0.55 Allowed 'General case' 0 C--O 1.239 0.524 0 C-N-CA 124.385 1.074 . . . . 75.54 108.215 171.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 14.4 m120 -121.21 -50.03 2.15 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.571 0.748 . . . . 65.33 109.762 -177.595 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -143.06 115.33 0.91 Allowed Glycine 0 C--N 1.348 1.215 0 CA-C-N 115.705 -0.68 . . . . 71.53 112.027 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 40.5 mtmt -76.4 110.92 11.33 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.749 0.82 . . . . 64.32 109.776 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.9 p -104.38 -163.38 0.96 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 123.687 0.795 . . . . 72.34 109.408 179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -66.38 -24.66 66.52 Favored 'General case' 0 N--CA 1.483 1.197 0 O-C-N 121.788 -0.57 . . . . 65.3 109.681 167.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 21.5 m-20 63.22 -80.54 0.03 OUTLIER 'General case' 0 C--N 1.361 1.091 0 C-N-CA 125.386 1.474 . . . . 73.54 111.482 175.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.547 ' HE2' ' HG ' ' A' ' 44' ' ' LEU . 5.6 p90 -153.73 80.86 1.16 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 123.901 0.88 . . . . 75.34 108.693 176.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 49.3 m -91.85 133.39 35.69 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 114.634 -1.167 . . . . 74.22 110.191 178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -128.07 153.71 46.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 124.257 1.023 . . . . 70.31 108.791 179.379 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 49.1 m -130.82 133.92 46.37 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.041 -0.726 . . . . 65.1 109.041 171.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 19.4 m -136.78 172.37 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 124.332 1.053 . . . . 75.04 110.07 178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 10.5 t -117.87 -5.24 11.06 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 123.344 0.658 . . . . 64.53 111.753 -173.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.465 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 17.2 m -142.55 154.31 44.35 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 122.574 0.35 . . . . 62.53 111.429 -170.701 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.453 ' HG3' ' HD3' ' A' ' 70' ' ' LYS . 18.9 mp0 -55.88 -49.6 72.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.063 1.345 . . . . 73.1 110.835 175.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.2 m -57.91 -38.64 76.23 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.343 1.057 . . . . 74.31 111.632 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.545 ' HA ' ' HD2' ' A' ' 39' ' ' LYS . 17.2 mm-40 -76.97 -22.77 52.71 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.274 -0.876 . . . . 63.33 111.364 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 58.5 tp -71.89 -43.84 64.72 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 122.97 0.508 . . . . 74.42 110.206 172.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.452 ' HG3' ' O ' ' A' ' 34' ' ' GLU . 88.9 mt-30 -60.82 -41.21 95.29 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.006 0.923 . . . . 75.25 111.216 -175.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 36' ' ' GLU . 12.5 ptmt -65.85 -39.32 90.67 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 123.609 0.568 . . . . 65.51 109.918 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 5.4 t -66.33 -44.03 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.319 1.048 . . . . 72.14 111.023 179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.523 ' HB3' HG21 ' A' ' 78' ' ' VAL . 56.6 mt -72.97 -31.39 64.51 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.349 0.66 . . . . 64.03 112.019 -176.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 57.4 t30 -66.6 -36.62 83.06 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.417 0.687 . . . . 61.34 109.976 177.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 22.4 tt0 -73.44 -49.09 28.7 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.816 -1.084 . . . . 74.44 110.351 175.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.547 ' HG ' ' HE2' ' A' ' 27' ' ' TYR . 8.2 tt -61.45 -30.63 70.71 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 125.683 1.593 . . . . 70.44 111.24 -176.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.406 ' HB2' HG13 ' A' ' 78' ' ' VAL . 35.8 ttpt -57.27 -46.37 83.13 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.395 1.478 . . . . 63.33 111.187 174.416 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -59.21 -44.62 92.25 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.049 -0.978 . . . . 71.53 110.765 177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -63.42 -45.1 92.51 Favored 'General case' 0 CA--C 1.554 1.13 0 O-C-N 124.025 0.828 . . . . 54.31 111.734 -176.235 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.6 mt -59.75 -42.26 88.17 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.042 0.537 . . . . 74.53 110.054 176.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.34 -34.48 70.57 Favored 'General case' 0 CA--C 1.55 0.973 0 CA-C-N 115.089 -0.96 . . . . 71.0 111.851 -178.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -78.69 -46.65 18.6 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.766 0.826 . . . . 73.44 110.224 -171.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.452 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 1.3 mp0 -72.87 127.19 31.81 Favored 'General case' 0 CA--C 1.542 0.636 0 N-CA-C 108.687 -0.857 . . . . 75.4 108.687 170.858 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -84.04 54.22 4.92 Favored Glycine 0 C--N 1.343 0.951 0 N-CA-C 111.441 -0.664 . . . . 73.03 111.441 179.277 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 18' ' ' ASN . 65.9 m -74.23 147.6 42.31 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 123.435 0.694 . . . . 74.51 110.664 -176.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.427 ' O ' ' HD2' ' A' ' 55' ' ' ARG . 46.6 mtmt -62.89 -58.83 6.03 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 124.133 0.896 . . . . 75.43 109.244 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 54' ' ' LYS . 9.9 mmm180 -129.2 149.84 50.84 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.616 0.766 . . . . 63.32 109.424 168.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.9 m -134.78 130.76 36.64 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.136 0.974 . . . . 61.5 108.777 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.431 ' HG2' ' HG3' ' A' ' 99' ' ' GLU . 32.9 mtm180 -123.83 119.34 29.4 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.649 0.779 . . . . 72.52 109.871 -174.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.61 ' HB ' HD21 ' A' ' 75' ' ' LEU . 57.3 m -99.33 122.65 42.76 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.139 0.576 . . . . 63.35 109.555 176.097 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.2 t -111.23 122.24 47.36 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.672 0.789 . . . . 74.34 109.221 177.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 67.5 mt -116.58 141.29 35.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.79 -0.819 . . . . 72.02 108.79 176.681 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 60.1 m -59.11 111.66 1.41 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 123.309 0.643 . . . . 62.44 111.795 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.406 ' HB1' ' HA ' ' A' ' 68' ' ' ALA . . . -125.88 31.49 5.47 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.039 1.336 . . . . 52.33 110.226 -175.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.538 ' HA ' ' HA ' ' A' ' 94' ' ' ASP . 13.8 ptm180 -58.61 -33.74 70.36 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.458 1.103 . . . . 75.25 112.71 -176.361 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 20.8 p -95.25 132.87 39.76 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 124.278 1.031 . . . . 74.54 108.698 172.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt -62.82 -32.27 73.43 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.937 0.895 . . . . 75.23 112.65 -172.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 50.4 tttp -61.92 -50.47 72.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.99 0.916 . . . . 61.12 109.834 176.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.41 ' HA ' ' HB3' ' A' ' 70' ' ' LYS . 1.1 mp0 -70.15 -21.95 63.03 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-N 115.179 -0.919 . . . . 73.31 111.83 176.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.406 ' HA ' ' HB1' ' A' ' 62' ' ' ALA . . . -67.53 -46.99 71.2 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 122.803 0.441 . . . . 74.33 110.511 175.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -64.47 -43.44 94.2 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.568 1.147 . . . . 75.42 110.566 176.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' HD3' ' HG3' ' A' ' 34' ' ' GLU . 40.5 ttmt -65.37 -61.04 2.35 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 125.145 1.378 . . . . 64.12 112.021 -174.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.4 ' O ' ' HB2' ' A' ' 75' ' ' LEU . 18.0 m-30 -68.95 -18.61 64.11 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.373 -0.831 . . . . 74.21 111.252 -175.417 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.486 ' O ' HD13 ' A' ' 76' ' ' ILE . . . -63.19 -52.96 60.24 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.914 0.759 . . . . 61.34 109.514 176.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -56.4 -47.2 79.46 Favored 'General case' 0 N--CA 1.478 0.943 0 O-C-N 123.736 0.647 . . . . 72.43 111.306 -177.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 78' ' ' VAL . 44.7 mt -63.81 -44.69 98.27 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-N 115.464 -0.789 . . . . 73.31 110.426 -178.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.61 HD21 ' HB ' ' A' ' 58' ' ' THR . 1.4 tt -64.21 -42.7 96.5 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.112 0.965 . . . . 74.21 110.31 -177.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.486 HD13 ' O ' ' A' ' 72' ' ' ALA . 1.6 mp -63.4 -38.71 82.89 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 123.696 0.798 . . . . 74.52 110.135 178.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -66.23 -37.34 85.3 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.867 0.467 . . . . 64.01 111.886 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.523 HG21 ' HB3' ' A' ' 41' ' ' LEU . 93.2 t -58.04 -49.84 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 123.334 0.654 . . . . 63.44 109.87 174.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 -72.6 -19.67 61.43 Favored 'General case' 0 N--CA 1.481 1.078 0 CA-C-N 115.041 -0.982 . . . . 74.51 112.133 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.495 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -75.12 -30.75 60.93 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.138 0.575 . . . . 30.43 111.017 177.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -78.39 -26.26 46.45 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 115.35 -0.841 . . . . 65.23 110.584 173.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 94.4 mt -82.75 -27.07 31.32 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.441 0.697 . . . . 74.3 111.513 177.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.69 -121.11 1.06 Allowed Glycine 0 C--N 1.341 0.858 0 N-CA-C 112.079 -0.408 . . . . 74.23 112.079 -172.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.495 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 52.7 m-85 -93.76 155.13 17.4 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.789 0.836 . . . . 74.33 109.859 -177.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . 0.454 ' HA ' ' HB1' ' A' ' 80' ' ' ALA . 0.8 OUTLIER -61.79 -40.21 94.41 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.209 0.604 . . . . 70.31 110.158 -178.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -84.56 109.56 18.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.138 -0.937 . . . . 71.42 109.465 176.467 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 34.8 mm -125.05 138.9 52.76 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 N-CA-C 107.281 -1.378 . . . . 70.3 107.281 174.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.5 p30 -88.97 145.13 25.7 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.793 0.724 . . . . 64.01 111.321 -173.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.4 ' HA ' HG22 ' A' ' 98' ' ' VAL . 40.2 t -92.46 122.42 43.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 124.118 0.967 . . . . 74.34 108.998 -179.067 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.496 ' HB ' ' O ' ' A' ' 97' ' ' THR . 32.7 m -116.17 104.78 11.88 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 108.055 -1.091 . . . . 73.31 108.055 172.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -104.23 107.17 17.94 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.104 0.962 . . . . 72.03 108.912 -175.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -70.61 -45.49 65.16 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.009 0.924 . . . . 74.04 110.802 -177.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 157.98 -83.19 0.14 Allowed Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.278 -0.874 . . . . 64.25 111.009 -178.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.538 ' HA ' ' HA ' ' A' ' 63' ' ' ARG . 5.5 p-10 -74.81 -15.16 60.75 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.923 0.489 . . . . 72.21 110.841 177.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.02 151.12 40.48 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 125.017 1.327 . . . . 63.43 109.671 -177.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.487 HG22 HG23 ' A' ' 98' ' ' VAL . 6.9 p -113.02 108.93 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.861 0 C-N-CA 124.356 1.062 . . . . 55.51 108.383 172.47 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.496 ' O ' ' HB ' ' A' ' 90' ' ' THR . 17.3 m -102.45 101.17 11.35 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 108.698 -0.853 . . . . 71.12 108.698 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.487 HG23 HG22 ' A' ' 96' ' ' VAL . 47.2 t -97.54 125.43 50.67 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 C-N-CA 123.168 0.587 . . . . 71.32 110.468 -174.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . 0.431 ' HG3' ' HG2' ' A' ' 57' ' ' ARG . 1.0 OUTLIER -153.42 126.39 8.39 Favored 'General case' 0 C--O 1.239 0.551 0 N-CA-C 108.045 -1.094 . . . . 71.41 108.045 172.773 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 117.19 153.0 9.68 Favored Glycine 0 C--N 1.345 1.047 0 N-CA-C 114.029 0.372 . . . . 31.13 114.029 168.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -77.07 147.34 36.74 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.222 1.009 . . . . 74.21 110.389 178.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 26.0 tp -105.29 136.37 44.95 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 107.777 -1.194 . . . . 61.43 107.777 168.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -160.46 155.85 25.07 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.481 0.312 . . . . 71.13 110.81 -175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.88 -66.77 3.67 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 111.456 -0.658 . . . . 73.53 111.456 -179.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.8 p -119.02 142.39 34.37 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.853 0 C-N-CA 124.023 0.929 . . . . 73.12 109.197 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 16.6 t70 . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.382 1.073 . . . . 75.23 108.698 176.71 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.6 mtt . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.729 -0.471 . . . . 71.11 109.729 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 16.5 m170 -74.65 118.46 17.63 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.436 0.694 . . . . 71.32 110.999 -177.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 48.7 p-80 -139.61 81.38 1.82 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 122.126 0.965 . . . . 72.41 109.313 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 88.1 m-70 -135.79 -11.38 2.04 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-N 115.345 -0.843 . . . . 72.31 110.618 176.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 23.8 m80 -114.44 174.42 5.96 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.703 0.801 . . . . 74.45 109.423 178.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 20.4 m-70 -84.2 110.24 18.38 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 123.151 0.58 . . . . 65.2 109.725 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 21.8 t-80 -128.06 115.7 18.86 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.111 0.564 . . . . 74.51 110.741 -175.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.498 ' HG2' ' H ' ' A' ' 9' ' ' SER . 24.7 ttt180 -83.82 177.46 8.33 Favored 'General case' 0 CA--C 1.568 1.663 0 C-N-CA 123.611 0.764 . . . . 74.41 109.127 172.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.498 ' H ' ' HG2' ' A' ' 8' ' ' ARG . 21.2 t 78.01 124.05 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.711 1.604 . . . . 74.35 109.668 -176.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.65 9.56 40.31 Favored Glycine 0 N--CA 1.469 0.847 0 CA-C-N 115.257 -0.883 . . . . 64.41 110.999 -164.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -73.85 159.77 32.39 Favored 'General case' 0 C--N 1.352 0.716 0 C-N-CA 124.501 1.121 . . . . 72.25 109.441 174.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 43.8 mt -70.06 101.91 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 N-CA-C 107.957 -1.127 . . . . 73.14 107.957 176.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -107.77 106.02 16.13 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 123.559 0.743 . . . . 61.44 109.587 -170.56 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 21.5 t -94.65 110.57 24.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 124.289 1.035 . . . . 61.42 109.619 -176.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.585 ' HG2' HG23 ' A' ' 28' ' ' THR . 98.9 mt-30 -117.56 108.59 15.67 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.081 -0.711 . . . . 62.33 109.081 176.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.502 ' HB3' ' HB2' ' A' ' 27' ' ' TYR . 25.1 t-20 -104.75 113.95 27.86 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.528 -0.916 . . . . 74.03 108.528 177.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.7 m120 -103.25 107.91 18.91 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 107.462 -1.31 . . . . 73.43 107.462 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 56' ' ' SER . 59.5 t30 -107.05 134.26 50.46 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.449 0.699 . . . . 53.13 109.239 -174.387 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.7 p -104.76 131.5 52.14 Favored 'General case' 0 C--O 1.244 0.81 0 C-N-CA 123.07 0.548 . . . . 72.03 110.883 -173.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.3 t 63.24 40.85 8.38 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 125.233 1.413 . . . . 61.12 111.46 179.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -86.4 -159.5 0.49 Allowed 'General case' 0 N--CA 1.479 0.988 0 CA-C-N 115.599 -0.728 . . . . 70.24 109.351 171.179 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -78.04 -150.91 4.8 Favored Glycine 0 C--N 1.349 1.271 0 N-CA-C 112.309 -0.316 . . . . 71.14 112.309 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 27.3 ttpp -85.59 -12.33 51.79 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.554 0.742 . . . . 73.23 110.678 177.069 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.9 m -60.46 129.47 41.78 Favored 'General case' 0 C--N 1.356 0.851 0 C-N-CA 123.978 0.911 . . . . 72.42 110.841 176.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -69.73 167.74 16.45 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.482 0.713 . . . . 75.13 111.642 -174.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -54.71 135.1 47.48 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 124.736 1.214 . . . . 64.54 111.492 177.439 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.502 ' HB2' ' HB3' ' A' ' 16' ' ' ASN . 37.1 m-85 -82.55 87.83 6.67 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.535 0.734 . . . . 73.35 110.128 -171.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.585 HG23 ' HG2' ' A' ' 15' ' ' GLN . 50.1 m -110.98 120.6 42.91 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.795 0.838 . . . . 52.42 110.922 -177.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -135.8 145.18 46.22 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.945 1.298 . . . . 63.54 108.392 -177.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 63.2 m -127.72 105.3 8.36 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 109.008 -0.738 . . . . 65.23 109.008 175.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.407 ' HB ' ' HB2' ' A' ' 36' ' ' GLU . 33.1 m -109.21 148.03 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.683 0 C-N-CA 123.678 0.791 . . . . 74.45 110.341 -178.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 14.5 t -102.31 -4.78 25.08 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.314 0.645 . . . . 53.2 111.706 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.537 ' HB ' ' HG2' ' A' ' 36' ' ' GLU . 60.6 m -140.96 147.84 39.4 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 123.91 0.884 . . . . 71.22 110.156 -173.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -72.5 -29.94 64.07 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.152 0.981 . . . . 74.33 112.745 -171.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.5 ' O ' ' HG2' ' A' ' 39' ' ' LYS . 23.6 p -59.06 -49.86 76.29 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 109.363 -0.606 . . . . 73.43 109.363 174.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.537 ' HG2' ' HB ' ' A' ' 33' ' ' THR . 4.8 mm-40 -57.18 -38.47 73.66 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 124.453 1.096 . . . . 72.51 111.07 179.217 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 55.9 tp -60.27 -52.45 65.23 Favored 'General case' 0 C--N 1.351 0.639 0 CA-C-N 114.776 -1.102 . . . . 72.55 111.523 178.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -65.7 -31.11 71.93 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 116.27 -0.423 . . . . 75.53 111.468 -176.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.5 ' HG2' ' O ' ' A' ' 35' ' ' SER . 9.1 mmpt? -65.96 -45.97 79.77 Favored 'General case' 0 CA--C 1.546 0.801 0 O-C-N 123.769 0.668 . . . . 74.32 110.05 177.377 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 7.5 p -77.74 -36.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 CA-C-O 119.438 -0.315 . . . . 73.21 111.598 -173.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 53.7 mt -66.96 -26.84 67.02 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.995 0.518 . . . . 75.31 111.74 179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.71 -53.94 49.36 Favored 'General case' 0 N--CA 1.473 0.693 0 O-C-N 123.76 0.663 . . . . 71.21 109.863 174.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -68.28 -37.45 80.7 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.207 0.603 . . . . 73.41 111.42 179.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 8.1 tt -62.21 -39.44 92.8 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 124.282 1.033 . . . . 74.35 110.171 -175.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.51 ' HB2' HG13 ' A' ' 78' ' ' VAL . 22.5 ttpp -52.76 -51.0 62.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 124.827 1.251 . . . . 74.12 111.149 171.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -75.19 -20.08 59.48 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 115.611 -0.722 . . . . 74.51 112.379 -175.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -71.76 -43.4 65.82 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.677 0.391 . . . . 51.22 110.43 174.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.7 mt -63.43 -40.46 89.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.362 0 C-N-CA 124.138 0.975 . . . . 62.24 109.979 176.31 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -67.23 -38.13 84.73 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.731 -1.122 . . . . 65.42 111.006 179.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 24.1 ttmm -63.96 -43.12 96.76 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.821 0.848 . . . . 72.34 111.079 177.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 10.4 pt20 -149.75 127.28 11.57 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.387 -0.824 . . . . 74.44 109.396 -175.466 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 151.14 85.22 0.05 OUTLIER Glycine 0 C--N 1.348 1.218 0 N-CA-C 110.725 -0.95 . . . . 74.43 110.725 -176.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 37.3 m -73.1 -31.04 64.08 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.294 0.637 . . . . 62.41 112.133 -174.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -98.23 -98.9 0.21 Allowed 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 108.95 -0.759 . . . . 71.02 108.95 179.25 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -156.55 153.39 28.61 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 119.396 0.998 . . . . 61.24 110.151 177.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.476 ' HA ' ' HA ' ' A' ' 18' ' ' ASN . 77.4 p -89.42 153.77 20.58 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 123.595 0.758 . . . . 64.25 110.52 173.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -128.14 106.92 9.38 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 108.018 -1.104 . . . . 73.15 108.018 174.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.3 m -97.77 138.15 35.57 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 109.692 -0.484 . . . . 73.5 109.692 -178.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 96' ' ' VAL . 66.1 m -129.21 118.74 22.87 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.634 -0.876 . . . . 75.14 108.634 177.008 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 38.6 mt -121.2 139.24 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 123.738 0.815 . . . . 73.53 109.474 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.5 m -53.27 105.19 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 123.997 0.919 . . . . 73.04 111.63 179.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.564 ' HA ' ' HB3' ' A' ' 67' ' ' GLU . . . -139.81 99.26 3.65 Favored 'General case' 0 CA--C 1.527 0.075 0 C-N-CA 124.509 1.124 . . . . 74.3 108.8 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.404 ' HG3' HG23 ' A' ' 64' ' ' THR . 10.5 ptm180 -106.8 -41.34 5.24 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.531 0.567 . . . . 73.1 112.531 -168.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.404 HG23 ' HG3' ' A' ' 63' ' ' ARG . 12.5 p -103.17 -177.96 3.52 Favored 'General case' 0 N--CA 1.487 1.402 0 CA-C-N 118.207 0.458 . . . . 63.31 110.408 176.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -61.88 -32.12 72.45 Favored 'General case' 0 C--N 1.357 0.917 0 C-N-CA 123.392 0.677 . . . . 72.2 111.751 -178.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 62.4 mttp -67.02 -55.05 16.07 Favored 'General case' 0 C--N 1.36 1.042 0 O-C-N 123.465 0.478 . . . . 70.55 111.142 -179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.564 ' HB3' ' HA ' ' A' ' 62' ' ' ALA . 3.0 mp0 -64.28 -34.65 78.62 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.738 0.304 . . . . 71.53 110.417 -178.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.17 -45.6 87.66 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 123.581 0.752 . . . . 71.43 111.708 177.347 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 66' ' ' LYS . 12.8 pt-20 -72.22 -41.16 67.19 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.384 0.274 . . . . 73.44 111.05 -175.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.407 ' O ' HG13 ' A' ' 74' ' ' ILE . 20.0 ptmt -80.77 -48.16 12.9 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 112.292 0.479 . . . . 63.33 112.292 -170.246 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -76.06 -34.39 59.59 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 122.716 0.406 . . . . 75.44 111.393 -173.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.54 ' HB2' HG21 ' A' ' 96' ' ' VAL . . . -64.17 -40.06 95.32 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 123.32 0.387 . . . . 63.24 110.705 175.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.412 ' O ' ' HD2' ' A' ' 77' ' ' LYS . . . -58.56 -47.54 83.89 Favored 'General case' 0 N--CA 1.476 0.833 0 O-C-N 123.735 0.647 . . . . 63.42 110.899 177.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 70' ' ' LYS . 51.9 mt -59.53 -42.4 87.89 Favored 'Isoleucine or valine' 0 C--N 1.357 0.909 0 O-C-N 123.967 0.792 . . . . 35.52 110.335 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.1 mt -67.71 -36.85 81.38 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.125 0.57 . . . . 72.0 112.217 -177.204 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.518 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.6 mp -68.59 -32.64 56.01 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.163 0 N-CA-C 109.59 -0.522 . . . . 71.31 109.59 175.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HD2' ' O ' ' A' ' 73' ' ' ALA . 1.1 mpmm? -67.04 -47.49 71.2 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 123.088 0.555 . . . . 73.24 111.321 174.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.51 HG13 ' HB2' ' A' ' 45' ' ' LYS . 53.2 t -57.8 -47.75 85.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.053 0.941 . . . . 75.32 110.111 178.309 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -73.39 -22.62 60.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.051 -0.977 . . . . 75.24 112.038 -179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.429 ' HA ' ' O ' ' A' ' 84' ' ' TYR . . . -69.72 -36.84 76.23 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-O 120.738 0.304 . . . . 33.33 110.587 177.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -73.73 -20.05 60.62 Favored 'General case' 0 N--CA 1.479 0.979 0 CA-C-N 115.782 -0.645 . . . . 73.2 111.538 175.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.38 -14.28 19.23 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.915 0.886 . . . . 70.14 111.786 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -144.12 -133.29 2.67 Favored Glycine 0 C--N 1.339 0.743 0 N-CA-C 111.245 -0.742 . . . . 71.35 111.245 -177.557 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . 0.429 ' O ' ' HA ' ' A' ' 80' ' ' ALA . 51.7 m-85 -93.92 166.23 12.27 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.365 0.666 . . . . 73.01 109.883 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -58.28 -43.03 87.78 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.457 0.703 . . . . 72.4 109.958 177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.533 ' HB3' HD21 ' A' ' 102' ' ' LEU . 38.1 m-20 -80.26 121.06 25.16 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 114.78 -1.1 . . . . 55.41 109.527 176.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 43.3 mm -130.7 151.89 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 C-N-CA 124.481 1.113 . . . . 73.05 109.628 -179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -89.4 145.94 25.0 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 122.912 0.485 . . . . 71.13 110.766 178.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.518 ' HB ' HD11 ' A' ' 76' ' ' ILE . 11.1 p -125.8 149.45 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.745 0 C-N-CA 123.793 0.837 . . . . 72.25 109.475 174.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 85.7 m -143.89 105.81 4.34 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.584 0.754 . . . . 51.13 109.031 173.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 23.7 t90 -92.25 133.95 35.34 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 109.007 -0.738 . . . . 75.42 109.007 176.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -101.82 -68.77 0.81 Allowed 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 122.907 0.483 . . . . 74.42 110.184 -175.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . -159.99 -82.31 0.04 OUTLIER Glycine 0 C--N 1.349 1.26 0 CA-C-N 116.073 -0.512 . . . . 61.11 111.973 -176.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 -92.43 -2.7 56.11 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.356 0.662 . . . . 64.32 111.365 179.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 23.3 m -145.85 134.13 21.76 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 123.457 0.703 . . . . 25.44 110.401 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.54 HG21 ' HB2' ' A' ' 72' ' ' ALA . 12.1 p -94.55 131.83 40.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 122.804 0.442 . . . . 62.01 109.817 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 59.0 m -111.11 138.24 47.78 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.843 0.857 . . . . 75.31 109.909 179.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.2 t -133.95 120.82 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.455 0.702 . . . . 71.45 109.718 178.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -151.02 159.74 44.37 Favored 'General case' 0 N--CA 1.474 0.735 0 N-CA-C 108.238 -1.023 . . . . 60.41 108.238 168.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 70.47 -151.14 49.3 Favored Glycine 0 C--N 1.345 1.028 0 N-CA-C 114.361 0.505 . . . . 72.53 114.361 170.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -161.21 143.54 12.24 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.1 0.56 . . . . 72.31 110.162 -173.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.582 ' H ' HD23 ' A' ' 102' ' ' LEU . 1.9 pt? -64.08 110.21 2.09 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-O 121.389 0.614 . . . . 71.01 110.042 174.076 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -94.35 132.58 38.82 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.829 0.852 . . . . 75.24 110.007 -178.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 165.02 -80.31 0.12 Allowed Glycine 0 C--N 1.339 0.736 0 N-CA-C 110.712 -0.955 . . . . 65.31 110.712 -177.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 33.9 m -101.17 153.47 4.88 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.972 0 C-N-CA 123.671 0.788 . . . . 70.42 110.515 177.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 22.1 t70 . . . . . 0 N--CA 1.477 0.922 0 C-N-CA 123.831 0.852 . . . . 73.54 109.099 178.871 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.474 0.757 0 N-CA-C 109.879 -0.415 . . . . 70.3 109.879 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -147.97 -60.41 0.26 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.035 0.934 . . . . 65.11 110.14 176.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.9 m80 -85.23 52.55 2.48 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.57 0.748 . . . . 64.45 111.343 -173.732 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.4 p-80 -81.75 130.7 35.15 Favored 'General case' 0 CA--C 1.55 0.949 0 C-N-CA 123.439 0.696 . . . . 72.14 109.769 178.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 72.01 13.33 5.93 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.498 1.519 . . . . 61.43 112.249 -175.572 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 12.0 t-160 -72.89 -41.82 64.24 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 108.631 -0.877 . . . . 74.22 108.631 171.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 -169.3 153.29 5.27 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.061 0.944 . . . . 64.42 108.883 167.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.3 ptt180 -87.93 97.67 11.07 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-O 121.416 0.627 . . . . 75.35 110.052 177.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 62.4 p -107.45 102.06 11.36 Favored 'General case' 0 C--O 1.244 0.769 0 C-N-CA 123.302 0.641 . . . . 62.44 109.618 176.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 164.13 62.03 0.02 OUTLIER Glycine 0 C--N 1.342 0.884 0 CA-C-N 115.741 -0.663 . . . . 53.21 111.989 -178.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -69.88 145.99 51.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.353 0.597 . . . . 70.14 110.519 178.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.8 mt -93.72 104.52 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 124.039 0.935 . . . . 72.11 110.274 -169.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.437 HE21 ' HB2' ' A' ' 15' ' ' GLN . 38.9 tt0 -87.28 114.99 24.38 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 108.967 -0.753 . . . . 72.51 108.967 172.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 40.9 t -92.85 107.55 19.22 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.553 0 N-CA-C 107.785 -1.191 . . . . 64.53 107.785 172.104 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.437 ' HB2' HE21 ' A' ' 13' ' ' GLN . 9.6 tt0 -117.64 108.04 14.95 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 109.161 -0.681 . . . . 74.21 109.161 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -114.11 139.07 49.62 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.702 0.801 . . . . 61.41 109.455 177.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -128.92 141.88 51.13 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 124.864 1.266 . . . . 74.33 107.985 179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.457 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 43.7 m-80 -130.98 142.44 50.35 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.471 0.708 . . . . 65.43 109.306 -179.022 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 49.7 m -95.4 106.78 18.87 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 107.422 -1.325 . . . . 73.41 107.422 168.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 26.4 p -165.0 135.57 3.89 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 123.896 0.879 . . . . 32.53 109.212 -170.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -66.76 113.1 4.6 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.477 0.711 . . . . 72.35 110.553 -179.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.14 154.13 6.42 Favored Glycine 0 C--N 1.338 0.67 0 N-CA-C 110.907 -0.877 . . . . 63.34 110.907 -179.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.9 -34.87 59.97 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.064 0.546 . . . . 71.12 110.961 -176.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 74.4 p -97.79 92.93 6.09 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 123.189 0.596 . . . . 55.33 111.506 -175.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 34.9 p90 -137.05 17.19 3.01 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.15 0.98 . . . . 53.34 109.781 173.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.33 102.39 15.08 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.02 1.328 . . . . 74.23 109.158 -175.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 38.6 m-85 -122.41 79.73 1.65 Allowed 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.067 0.547 . . . . 74.35 109.778 -177.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.5 m -128.81 122.21 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.501 0.72 . . . . 62.15 110.112 -179.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -131.58 165.74 22.96 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.241 1.417 . . . . 74.45 108.748 -177.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 26.0 m -132.67 126.49 32.74 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.485 0.714 . . . . 62.02 109.08 172.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.407 HG21 ' HB2' ' A' ' 37' ' ' LEU . 32.8 m -125.99 139.2 52.2 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 C-N-CA 124.334 1.054 . . . . 61.11 110.019 -177.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 11.5 t -102.71 9.9 38.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.319 0.648 . . . . 75.34 110.38 179.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 63.0 m -147.06 142.73 27.74 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.778 0.831 . . . . 74.44 110.084 -171.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 38' ' ' GLN . 47.0 mt-10 -63.58 -46.26 86.67 Favored 'General case' 0 C--O 1.217 -0.65 0 C-N-CA 123.889 0.875 . . . . 73.43 111.884 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.2 p -58.8 -36.0 73.76 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.333 0.653 . . . . 74.42 111.526 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 14.3 mm-40 -63.52 -44.81 93.19 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 115.005 -0.998 . . . . 71.51 110.508 173.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.465 HD11 HD13 ' A' ' 60' ' ' ILE . 67.7 tp -60.91 -38.78 86.91 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.011 0.925 . . . . 70.5 111.448 177.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.444 ' HG2' ' O ' ' A' ' 34' ' ' GLU . 22.8 mm-40 -66.27 -43.62 85.93 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 122.812 0.445 . . . . 73.42 110.892 -173.802 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -79.17 -34.89 42.72 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-N 116.105 -0.498 . . . . 74.11 111.398 -177.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.7 p -69.78 -33.91 58.3 Favored 'Isoleucine or valine' 0 C--N 1.356 0.872 0 O-C-N 123.25 0.344 . . . . 51.33 110.614 -174.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 HD11 ' A' ' 60' ' ' ILE . 77.0 mt -70.34 -26.02 63.55 Favored 'General case' 0 C--N 1.355 0.821 0 C-N-CA 123.148 0.579 . . . . 63.45 111.25 176.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.98 -37.92 46.19 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.227 0.611 . . . . 54.11 110.969 177.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -66.53 -49.6 65.97 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.921 0.889 . . . . 70.42 109.529 175.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.4 tt -58.39 -40.91 83.62 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.407 1.483 . . . . 64.45 110.548 178.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -58.58 -50.52 73.51 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.814 1.246 . . . . 75.23 111.31 176.033 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -59.95 -33.13 71.51 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.339 1.056 . . . . 74.5 111.086 -178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.481 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 19.9 m-30 -69.0 -51.08 43.02 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.828 -0.624 . . . . 74.32 110.758 177.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 70.2 mt -57.16 -35.78 49.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 C-N-CA 124.033 0.933 . . . . 62.23 110.878 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -59.09 -41.12 87.3 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 124.423 1.089 . . . . 74.43 111.347 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -87.15 -6.17 58.74 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.868 0.867 . . . . 64.54 112.47 177.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.608 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 13.8 mm100 -87.8 152.56 22.02 Favored 'General case' 0 N--CA 1.479 0.99 0 N-CA-C 109.372 -0.603 . . . . 54.15 109.372 171.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -88.31 51.82 4.0 Favored Glycine 0 C--N 1.345 1.045 0 N-CA-C 111.361 -0.695 . . . . 62.42 111.361 175.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 51' ' ' GLN . 60.6 m -69.18 100.68 1.32 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.072 0.949 . . . . 72.02 111.824 -172.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -55.12 -42.86 73.51 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 123.935 0.772 . . . . 75.34 109.427 167.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.495 ' HA ' ' NE ' ' A' ' 55' ' ' ARG . 0.1 OUTLIER -146.13 147.03 31.11 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 115.113 -0.949 . . . . 71.01 109.565 175.123 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 52.9 p -127.55 137.11 52.52 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.868 0.867 . . . . 42.14 108.716 177.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -131.07 112.97 13.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.44 -0.948 . . . . 74.34 108.44 179.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 14.8 m -105.02 129.63 53.41 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 108.895 -0.779 . . . . 72.12 108.895 177.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.445 ' HB3' HG21 ' A' ' 95' ' ' THR . 50.2 m -128.05 118.7 23.95 Favored 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 124.312 1.045 . . . . 72.15 108.241 -179.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.465 HD13 HD11 ' A' ' 37' ' ' LEU . 40.8 mt -118.65 137.85 51.26 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 123.602 0.761 . . . . 73.41 109.453 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 49.0 m -62.17 114.29 3.36 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.345 0.658 . . . . 71.04 111.663 -179.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -144.41 102.82 3.89 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.463 1.105 . . . . 71.21 108.259 177.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.45 ' HD2' ' H ' ' A' ' 63' ' ' ARG . 0.1 OUTLIER -97.42 -37.89 9.83 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 108.582 -0.896 . . . . 75.44 108.582 171.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.7 p -80.82 145.86 31.2 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.832 1.253 . . . . 51.43 110.39 179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -79.76 -28.26 40.43 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.545 0.943 . . . . 73.45 113.545 -163.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -68.13 -43.11 79.09 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 108.922 -0.77 . . . . 63.11 108.922 173.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -65.16 -37.16 86.49 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-N 114.513 -1.222 . . . . 75.43 110.87 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -56.42 -42.28 77.76 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 124.033 0.933 . . . . 33.23 111.434 176.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -79.42 -48.0 14.73 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 123.669 0.788 . . . . 50.04 112.748 -176.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -70.26 -40.08 74.6 Favored 'General case' 0 N--CA 1.475 0.825 0 CA-C-O 119.552 -0.261 . . . . 74.15 111.043 -173.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 13.7 m-30 -68.05 -39.67 82.99 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 109.758 -0.46 . . . . 73.24 109.758 178.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.94 -47.2 85.9 Favored 'General case' 0 C--N 1.352 0.678 0 O-C-N 123.885 0.741 . . . . 74.51 111.051 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -58.2 -47.32 83.82 Favored 'General case' 0 CA--C 1.541 0.621 0 O-C-N 123.954 0.784 . . . . 42.21 111.0 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.442 ' O ' HG23 ' A' ' 78' ' ' VAL . 91.0 mt -62.09 -39.4 83.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.908 0 C-N-CA 124.093 0.957 . . . . 73.45 111.157 179.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.444 ' HB2' HG21 ' A' ' 98' ' ' VAL . 76.4 mt -74.1 -31.84 62.97 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 112.207 0.447 . . . . 64.45 112.207 -178.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.452 HD11 ' HB ' ' A' ' 89' ' ' VAL . 1.7 mp -62.84 -38.49 81.95 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 N-CA-C 108.611 -0.885 . . . . 61.15 108.611 170.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.409 ' O ' ' HG2' ' A' ' 81' ' ' GLU . 14.0 mmmm -66.1 -44.17 85.14 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.077 0.551 . . . . 64.32 111.874 176.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 74' ' ' ILE . 75.7 t -59.67 -44.45 93.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 C-N-CA 123.848 0.859 . . . . 73.41 110.663 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 3.1 m-85 -69.17 -31.87 70.8 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-N 115.054 -0.976 . . . . 73.34 111.513 178.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -72.85 -29.64 63.36 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.129 0.571 . . . . 62.13 111.43 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 23.1 mm-40 -67.03 -42.97 83.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.69 0.796 . . . . 63.04 110.08 174.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 90.7 mt -78.94 -26.06 43.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.102 -0.954 . . . . 64.01 111.722 -177.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -149.7 -114.67 0.72 Allowed Glycine 0 C--N 1.345 1.055 0 O-C-N 123.384 0.428 . . . . 65.42 112.344 -175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -119.72 168.39 11.11 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.984 0.914 . . . . 74.04 110.757 -175.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -75.81 -8.59 57.23 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.886 0.874 . . . . 74.24 111.907 -177.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.55 ' HB3' ' HB2' ' A' ' 102' ' ' LEU . 7.7 m-20 -74.28 73.8 1.82 Allowed 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 124.715 1.206 . . . . 61.43 110.764 -177.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 30.3 mm -130.12 125.99 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 122.979 0.512 . . . . 72.42 110.211 -171.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 p-10 -101.74 151.27 22.24 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.214 0.606 . . . . 74.35 110.898 174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.452 ' HB ' HD11 ' A' ' 76' ' ' ILE . 6.5 p -117.06 150.11 19.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.438 1.095 . . . . 60.51 110.272 -178.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 97.6 m -139.47 106.98 5.56 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.673 0.789 . . . . 62.14 109.22 175.784 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -102.61 115.09 29.88 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.771 0.828 . . . . 62.52 109.382 178.521 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -146.3 141.89 27.75 Favored 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.03 0.932 . . . . 73.02 109.472 178.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 70.28 -133.3 23.93 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 123.734 0.647 . . . . 73.23 113.377 178.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -96.44 10.36 38.46 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.333 0.653 . . . . 72.23 111.102 -176.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' THR . . . . . 0.445 HG21 ' HB3' ' A' ' 59' ' ' SER . 86.7 m -145.03 135.57 24.32 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 122.993 0.517 . . . . 73.35 111.66 -169.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 7.1 p -92.53 117.3 35.59 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.18 0 N-CA-C 108.859 -0.793 . . . . 44.01 108.859 168.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 95.6 m -111.65 116.85 31.47 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.936 0.894 . . . . 75.41 109.979 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.444 HG21 ' HB2' ' A' ' 75' ' ' LEU . 75.8 t -101.45 116.16 44.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 C-N-CA 123.777 0.831 . . . . 73.54 109.783 174.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.61 129.57 11.03 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 106.947 -1.501 . . . . 63.45 106.947 172.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 140.64 100.42 0.43 Allowed Glycine 0 C--N 1.339 0.746 0 CA-C-O 119.674 -0.515 . . . . 73.13 112.878 173.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 54.1 tt0 -91.57 113.03 25.19 Favored 'General case' 0 C--N 1.347 0.483 0 N-CA-C 107.55 -1.278 . . . . 62.23 107.55 167.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.55 ' HB2' ' HB3' ' A' ' 86' ' ' ASP . 77.7 mt -75.97 116.75 16.98 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.569 0.748 . . . . 74.12 109.861 -179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -121.29 129.14 52.97 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 108.431 -0.951 . . . . 74.54 108.431 170.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 145.39 -127.01 2.72 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.072 -0.811 . . . . 64.0 111.072 -176.555 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 30.5 m -138.92 152.78 24.48 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.846 0.858 . . . . 72.23 110.351 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 21.6 t70 . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 123.783 0.833 . . . . 55.21 109.573 173.103 . . . . . . . . 0 0 . 1 stop_ save_