data_2m0c_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 2m0c _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 ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.555 1.154 0 CA-C-O 120.805 0.336 . . . . 73.239999999999995 111.248 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 64.510000000000005 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 70.549999999999997 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.340000000000003 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 73.340000000000003 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 75.230000000000004 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.140000000000001 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.010000000000005 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.319999999999993 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 74.430000000000007 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.530000000000001 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.140000000000001 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.532 ' HB3' ' HZ1' ' A' ' 30' ' ' LYS . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 75.340000000000003 111.204 172.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 73.319999999999993 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.140000000000001 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 72.319999999999993 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 71.439999999999998 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.420000000000002 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.530000000000001 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 73.530000000000001 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 74.209999999999994 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 75.099999999999994 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 73.299999999999997 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.150000000000006 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 75.420000000000002 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 73.25 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.109999999999999 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.310000000000002 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 63.439999999999998 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.109999999999999 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.439999999999998 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.547 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.310000000000002 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.409 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.310000000000002 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.519999999999996 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 71.299999999999997 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 74.439999999999998 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 75.030000000000001 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.340000000000003 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.209999999999994 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.230000000000004 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.519999999999996 110.29 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 75.040000000000006 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 74.140000000000001 111.801 176.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 74.450000000000003 111.167 177.165 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.399 0.618 . . . . 75.25 111.983 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.299999999999997 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 74.230000000000004 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.099999999999994 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.150000000000006 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 71.239999999999995 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.219999999999999 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.546 HD22 HD23 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.129999999999995 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.340000000000003 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 74.140000000000001 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 75.540000000000006 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 73.519999999999996 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 74.340000000000003 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 73.109999999999999 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 72.230000000000004 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.450000000000003 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 73.140000000000001 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.109999999999999 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.454 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.209999999999994 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 70.25 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 74.230000000000004 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.409999999999997 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.409999999999997 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.340000000000003 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.546 HD23 HD22 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 74.010000000000005 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.530000000000001 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 71.409999999999997 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 73.340000000000003 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.239999999999995 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.030000000000001 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.340000000000003 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.209999999999994 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.210000000000001 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 73.109999999999999 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.109999999999999 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.140000000000001 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.239999999999995 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.140000000000001 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 73.549999999999997 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 72.540000000000006 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.219999999999999 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 74.239999999999995 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 74.140000000000001 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.239999999999995 110.801 175.407 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.005 0.431 . . . . 72.540000000000006 111.775 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 62.229999999999997 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 70.5 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.340000000000003 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 74.140000000000001 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.310000000000002 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.409999999999997 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.568 HD22 HD23 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.439999999999998 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.010000000000005 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.450000000000003 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.239999999999995 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.340000000000003 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.0 mm-40 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.329999999999998 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.209999999999994 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.239999999999995 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.219999999999999 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.530000000000001 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.140000000000001 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.299999999999997 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.420000000000002 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 74.5 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 64.319999999999993 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 74.319999999999993 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 74.239999999999995 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 73.120000000000005 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.568 HD23 HD22 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 74.25 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.420000000000002 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.519999999999996 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 72.299999999999997 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.329999999999998 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.010000000000005 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.099999999999994 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.200000000000003 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.519999999999996 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.099999999999994 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 75.439999999999998 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.230000000000004 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 74.400000000000006 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.418 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 73.329999999999998 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.419 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.340000000000003 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 74.319999999999993 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 75.140000000000001 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.418 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 75.209999999999994 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.329999999999998 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 61.539999999999999 111.721 -178.165 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.079 0.466 . . . . 74.510000000000005 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.519999999999996 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 62.340000000000003 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.150000000000006 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.439999999999998 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.340000000000003 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.319999999999993 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 72.219999999999999 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.439999999999998 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.510000000000005 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 72.209999999999994 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 62.009999999999998 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 75.150000000000006 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 64.140000000000001 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 75.219999999999999 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.430000000000007 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.150000000000006 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.400000000000006 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.219999999999999 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 74.340000000000003 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 75.430000000000007 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 73.140000000000001 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 62.229999999999997 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.319999999999993 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HA ' ' HE1' ' A' ' 44' ' ' MET . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.319999999999993 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.030000000000001 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.505 ' HE1' ' HA ' ' A' ' 41' ' ' GLN . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 73.109999999999999 112.628 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 75.230000000000004 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 74.319999999999993 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 70.129999999999995 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.230000000000004 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.310000000000002 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.219999999999999 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 74.230000000000004 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.420000000000002 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.239999999999995 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.430000000000007 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 72.310000000000002 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.230000000000004 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.299999999999997 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 73.049999999999997 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 64.340000000000003 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.329999999999998 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.76 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.409999999999997 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.319999999999993 110.59 172.542 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.01 -0.367 . . . . 70.239999999999995 110.01 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.239999999999995 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.219999999999999 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 75.019999999999996 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.019999999999996 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 72.319999999999993 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.219999999999999 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 74.310000000000002 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.049999999999997 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 65.430000000000007 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 73.519999999999996 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 74.219999999999999 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.409999999999997 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.420000000000002 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 75.299999999999997 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.150000000000006 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 75.099999999999994 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 72.329999999999998 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 71.099999999999994 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 72.030000000000001 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.310000000000002 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.200000000000003 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 74.219999999999999 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 74.329999999999998 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 29.1 mm-40 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 72.129999999999995 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.420000000000002 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.310000000000002 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.430000000000007 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.530000000000001 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.340000000000003 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.409999999999997 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.129999999999995 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 71.319999999999993 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.209999999999994 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 74.109999999999999 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 75.420000000000002 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.349999999999994 110.663 172.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 75.340000000000003 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.409999999999997 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.109999999999999 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 73.329999999999998 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.239999999999995 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.510000000000005 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 74.420000000000002 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.009999999999998 111.794 -177.915 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.364 0.135 . . . . 74.340000000000003 111.364 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.120000000000005 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.120000000000005 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.403 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.540000000000006 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 74.329999999999998 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 74.219999999999999 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.409999999999997 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.463 HD23 HD23 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 72.409999999999997 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.209999999999994 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 71.420000000000002 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.400000000000006 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.443 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.120000000000005 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.239999999999995 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 72.510000000000005 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 73.120000000000005 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 72.209999999999994 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.540000000000006 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.030000000000001 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 64.510000000000005 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 74.340000000000003 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 73.299999999999997 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.209999999999994 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.430000000000007 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 75.430000000000007 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.463 HD23 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 74.209999999999994 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.150000000000006 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 74.109999999999999 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.310000000000002 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.403 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 75.519999999999996 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 72.120000000000005 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 70.25 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 74.150000000000006 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.219999999999999 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 71.540000000000006 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.430000000000007 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 73.239999999999995 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 75.099999999999994 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 72.319999999999993 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 75.030000000000001 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.57 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 74.430000000000007 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.150000000000006 110.933 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.430000000000007 110.225 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.099999999999994 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.57 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.310000000000002 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 73.420000000000002 111.134 172.303 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 108.509 -0.923 . . . . 75.439999999999998 108.509 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 61.509999999999998 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.310000000000002 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.219999999999999 111.14 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 73.0 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.239999999999995 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 55.5 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.4 HD23 HD23 ' A' ' 42' ' ' LEU . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.329999999999998 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 74.109999999999999 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 75.319999999999993 110.926 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 74.519999999999996 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 72.409999999999997 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.230000000000004 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 75.010000000000005 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.129999999999995 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 70.409999999999997 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.099999999999994 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.219999999999999 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.120000000000005 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 74.349999999999994 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 70.120000000000005 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.703 HH11 HG11 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 73.239999999999995 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.420000000000002 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 74.409999999999997 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.4 HD23 HD23 ' A' ' 24' ' ' LEU . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 70.319999999999993 112.264 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 65.209999999999994 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.450000000000003 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.329999999999998 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.430000000000007 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 75.299999999999997 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.239999999999995 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 73.530000000000001 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.443 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 73.420000000000002 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 75.540000000000006 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.438 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 75.340000000000003 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.703 HG11 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 74.349999999999994 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 70.230000000000004 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.530000000000001 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.329999999999998 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 74.430000000000007 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.019999999999996 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 73.400000000000006 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 75.349999999999994 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.400000000000006 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.539999999999999 111.317 173.491 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 120.537 0.208 . . . . 75.340000000000003 110.913 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.409999999999997 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.340000000000003 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.510000000000005 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 74.439999999999998 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 73.439999999999998 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.019999999999996 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 72.150000000000006 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 73.129999999999995 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 63.149999999999999 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.219999999999999 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.230000000000004 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 63.539999999999999 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.409999999999997 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.340000000000003 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 71.230000000000004 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 54.409999999999997 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.530000000000001 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.510000000000005 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.549999999999997 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 72.219999999999999 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.129999999999995 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.400000000000006 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 75.239999999999995 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 63.210000000000001 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 75.209999999999994 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.510000000000005 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 74.209999999999994 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.229999999999997 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 73.340000000000003 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.450000000000003 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.420000000000002 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 63.439999999999998 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 74.230000000000004 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 74.310000000000002 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.200000000000003 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.209999999999994 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.432 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 73.549999999999997 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 73.549999999999997 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 74.0 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.400000000000006 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.329999999999998 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.310000000000002 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.319999999999993 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.400000000000006 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 74.310000000000002 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 74.540000000000006 110.696 175.619 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.289 0.566 . . . . 71.120000000000005 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 72.310000000000002 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 71.420000000000002 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.439999999999998 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.530000000000001 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.430000000000007 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.340000000000003 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.420000000000002 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 72.340000000000003 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 73.510000000000005 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.150000000000006 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 74.430000000000007 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 73.400000000000006 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 70.519999999999996 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 73.439999999999998 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 74.299999999999997 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.430000000000007 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.329999999999998 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.409999999999997 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 73.230000000000004 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.230000000000004 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 75.200000000000003 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 73.040000000000006 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.019999999999996 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 70.120000000000005 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.010000000000005 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.349999999999994 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 74.430000000000007 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.430000000000007 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.450000000000003 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 75.519999999999996 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 71.150000000000006 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 73.409999999999997 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.420000000000002 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 64.299999999999997 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.340000000000003 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 72.349999999999994 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.450000000000003 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 75.019999999999996 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 74.5 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.530000000000001 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.430000000000007 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 74.310000000000002 111.34 176.107 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 112.899 0.703 . . . . 74.530000000000001 112.899 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 71.519999999999996 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 70.430000000000007 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.409999999999997 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.510000000000005 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 74.329999999999998 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.150000000000006 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.099999999999994 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 73.439999999999998 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.150000000000006 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 73.439999999999998 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.349999999999994 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.439999999999998 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.409999999999997 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 65.230000000000004 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.420000000000002 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.409999999999997 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.409999999999997 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 74.129999999999995 113.739 178.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.019999999999996 112.512 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.407 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.540000000000006 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 72.310000000000002 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 70.200000000000003 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 72.349999999999994 111.231 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.409999999999997 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 74.530000000000001 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.525 HD23 HD21 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.140000000000001 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 75.150000000000006 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 72.439999999999998 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 71.420000000000002 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.6 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 74.109999999999999 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 75.219999999999999 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.409999999999997 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.230000000000004 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.411 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.409999999999997 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' HD21 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 72.450000000000003 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 75.400000000000006 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.430000000000007 112.468 177.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.140000000000001 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 75.510000000000005 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 73.439999999999998 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.412 HE22 ' NH2' ' A' ' 61' ' ' ARG . 26.5 mm-40 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.230000000000004 109.951 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.420000000000002 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 74.209999999999994 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.412 ' NH2' HE22 ' A' ' 58' ' ' GLN . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.409999999999997 111.875 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 72.349999999999994 110.559 172.064 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 111.529 0.196 . . . . 75.430000000000007 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 73.400000000000006 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 61.229999999999997 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 74.310000000000002 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 75.540000000000006 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.329999999999998 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.209999999999994 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 64.150000000000006 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 42' ' ' LEU . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 64.340000000000003 111.128 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.120000000000005 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.619 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 74.129999999999995 111.816 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.329999999999998 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 74.120000000000005 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.349999999999994 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.019999999999996 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.030000000000001 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 72.349999999999994 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 74.540000000000006 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.129999999999995 112.924 -176.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.519999999999996 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 72.200000000000003 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.310000000000002 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.129999999999995 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 74.230000000000004 111.385 178.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.310000000000002 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 74.099999999999994 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 24' ' ' LEU . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 65.299999999999997 110.964 175.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 74.519999999999996 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 72.340000000000003 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.120000000000005 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.614 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 75.319999999999993 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.340000000000003 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 72.030000000000001 112.079 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 65.239999999999995 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.430000000000007 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.420000000000002 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.420000000000002 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 75.129999999999995 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.420000000000002 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 71.120000000000005 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.120000000000005 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.310000000000002 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.150000000000006 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 64.150000000000006 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.349999999999994 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 75.129999999999995 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 75.109999999999999 111.491 175.58 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 111.238 0.088 . . . . 73.109999999999999 111.238 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 71.120000000000005 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 63.119999999999997 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.109999999999999 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.534 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.150000000000006 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 64.209999999999994 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.140000000000001 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 73.420000000000002 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.569 HD23 HD23 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.329999999999998 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 64.219999999999999 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 65.209999999999994 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 74.109999999999999 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.109999999999999 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.040000000000006 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.219999999999999 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 74.140000000000001 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.319999999999993 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.648 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.310000000000002 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.319999999999993 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 75.200000000000003 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.420000000000002 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 74.239999999999995 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.510000000000005 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 75.430000000000007 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 73.349999999999994 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.569 HD23 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 62.240000000000002 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 74.439999999999998 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.409999999999997 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 74.530000000000001 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.534 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 73.450000000000003 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.120000000000005 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . 0.638 HD21 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.140000000000001 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 74.439999999999998 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 74.0 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.310000000000002 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.638 ' HG2' HD21 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.209999999999994 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.040000000000006 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.447 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.540000000000006 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 73.25 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.030000000000001 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.040000000000006 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.409999999999997 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 70.340000000000003 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.540000000000006 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.648 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.319999999999993 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 74.420000000000002 111.518 177.482 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 112.438 0.533 . . . . 72.219999999999999 112.438 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 75.230000000000004 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.230000000000004 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 75.219999999999999 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.519999999999996 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.219999999999999 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.099999999999994 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 73.239999999999995 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 72.530000000000001 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 75.310000000000002 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.523 HG22 HD11 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.420000000000002 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.417 ' HB2' ' HZ3' ' A' ' 56' ' ' TRP . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.109999999999999 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 72.0 mm-40 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.140000000000001 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 73.439999999999998 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 74.530000000000001 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 74.129999999999995 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.530000000000001 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.319999999999993 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.239999999999995 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.120000000000005 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.540000000000006 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 75.239999999999995 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.523 HD11 HG22 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 75.319999999999993 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 74.030000000000001 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 74.349999999999994 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.439999999999998 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.040000000000006 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 73.549999999999997 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.150000000000006 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.140000000000001 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.530000000000001 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.43 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 74.120000000000005 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.329999999999998 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 74.329999999999998 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.400000000000006 112.251 179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 72.420000000000002 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . 0.417 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.439999999999998 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.519999999999996 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' GLN . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 64.400000000000006 111.429 178.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 75.109999999999999 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.099999999999994 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.402 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.530000000000001 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 74.450000000000003 111.776 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 109.699 -0.482 . . . . 74.439999999999998 109.699 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 72.420000000000002 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.420000000000002 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.209999999999994 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.229999999999997 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 72.319999999999993 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.140000000000001 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.439999999999998 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.623 HD22 HD23 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 74.409999999999997 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.409999999999997 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.409999999999997 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.510000000000005 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 72.030000000000001 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 72.450000000000003 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 73.040000000000006 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 73.049999999999997 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.340000000000003 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.540000000000006 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 71.140000000000001 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.329999999999998 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.109999999999999 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 64.049999999999997 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 71.230000000000004 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.623 HD23 HD22 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 74.340000000000003 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.439999999999998 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.349999999999994 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 75.230000000000004 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.239999999999995 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 72.5 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.310000000000002 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.239999999999995 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.450000000000003 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.549999999999997 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 64.540000000000006 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.549999999999997 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 75.439999999999998 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 74.349999999999994 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 75.040000000000006 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.439999999999998 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.329999999999998 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 75.140000000000001 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.340000000000003 111.449 177.376 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 112.926 0.713 . . . . 75.230000000000004 112.926 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.530000000000001 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 72.239999999999995 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 72.420000000000002 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.120000000000005 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.329999999999998 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 73.420000000000002 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.519999999999996 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.040000000000006 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.010000000000005 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.540000000000006 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.444 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.209999999999994 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.340000000000003 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.219999999999999 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.444 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 73.349999999999994 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.329999999999998 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.430000000000007 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 75.439999999999998 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.530000000000001 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.239999999999995 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.409999999999997 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 73.420000000000002 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.140000000000001 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.019999999999996 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 74.349999999999994 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.510000000000005 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 64.109999999999999 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 71.400000000000006 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 75.319999999999993 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 74.239999999999995 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.340000000000003 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 74.420000000000002 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 73.140000000000001 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.349999999999994 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 74.230000000000004 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.310000000000002 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.409999999999997 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 72.230000000000004 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 72.219999999999999 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 64.319999999999993 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 71.319999999999993 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 74.0 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 73.209999999999994 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 73.230000000000004 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.349999999999994 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.310000000000002 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 75.310000000000002 111.578 173.349 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.941 -0.392 . . . . 73.340000000000003 109.941 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.420000000000002 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 70.010000000000005 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.319999999999993 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.030000000000001 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.329999999999998 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.520000000000003 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 64.200000000000003 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 75.5 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 74.120000000000005 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.299999999999997 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 61.549999999999997 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 73.109999999999999 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.439999999999998 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 74.430000000000007 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.020000000000003 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 75.209999999999994 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.420000000000002 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.140000000000001 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.340000000000003 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.486 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 73.200000000000003 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.099999999999994 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 73.310000000000002 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.439999999999998 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.129999999999995 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 74.409999999999997 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.239999999999995 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 71.319999999999993 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 74.030000000000001 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.530000000000001 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.239999999999995 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 74.140000000000001 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 75.420000000000002 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.049999999999997 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.209999999999994 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 71.340000000000003 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.049999999999997 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 71.319999999999993 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 70.310000000000002 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 75.439999999999998 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.430000000000007 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 74.319999999999993 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.310000000000002 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 72.400000000000006 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 74.299999999999997 112.667 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 74.409999999999997 111.154 176.115 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 110.26 -0.274 . . . . 71.019999999999996 110.26 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.140000000000001 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.209999999999994 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.340000000000003 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 64.030000000000001 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.530000000000001 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 74.019999999999996 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.329999999999998 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.508 HD22 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.409999999999997 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.209999999999994 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 72.219999999999999 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 74.230000000000004 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.409999999999997 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.109999999999999 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.430000000000007 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 71.299999999999997 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 74.200000000000003 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.430000000000007 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.120000000000005 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 72.430000000000007 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 72.549999999999997 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 70.030000000000001 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 71.430000000000007 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.5 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 74.030000000000001 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.508 HD21 HD22 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 70.450000000000003 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 74.420000000000002 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 62.420000000000002 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 74.340000000000003 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.150000000000006 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.540000000000006 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 73.409999999999997 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.040000000000006 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.401 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 65.409999999999997 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.120000000000005 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.401 HG21 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.530000000000001 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.450000000000003 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.239999999999995 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.219999999999999 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.319999999999993 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 74.109999999999999 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.530000000000001 110.461 171.208 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.955 -0.757 . . . . 73.120000000000005 108.955 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.310000000000002 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 62.240000000000002 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.049999999999997 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.420000000000002 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 74.510000000000005 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.109999999999999 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.420000000000002 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.150000000000006 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.230000000000004 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 73.120000000000005 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 64.299999999999997 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 65.299999999999997 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 79.3 mm-40 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.120000000000005 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.140000000000001 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.140000000000001 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.319999999999993 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 75.319999999999993 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 74.319999999999993 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.209999999999994 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 74.420000000000002 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.43 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 55.329999999999998 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.049999999999997 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 72.340000000000003 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.349999999999994 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 73.5 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.349999999999994 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 74.109999999999999 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 74.099999999999994 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 75.25 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 73.019999999999996 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 74.239999999999995 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.559 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 72.430000000000007 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.030000000000001 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 73.219999999999999 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.559 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 73.549999999999997 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 75.140000000000001 110.018 171.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.530000000000001 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.219999999999999 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 75.310000000000002 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.510000000000005 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.109999999999999 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 74.430000000000007 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 110.995 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 72.340000000000003 111.527 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 61.530000000000001 111.528 172.366 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 110.329 -0.248 . . . . 75.040000000000006 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 74.219999999999999 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.219999999999999 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 74.450000000000003 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.409999999999997 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 53.420000000000002 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.129999999999995 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 63.240000000000002 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 74.209999999999994 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 74.239999999999995 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.683 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 75.209999999999994 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.430000000000007 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.109999999999999 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.120000000000005 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 74.319999999999993 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.319999999999993 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . 0.419 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.319999999999993 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.420000000000002 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.439999999999998 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 72.430000000000007 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.239999999999995 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.319999999999993 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.66 HH11 HG11 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.299999999999997 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.519999999999996 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 73.109999999999999 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 75.319999999999993 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.010000000000005 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.140000000000001 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 71.129999999999995 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 73.019999999999996 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.340000000000003 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 75.109999999999999 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.129999999999995 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 53.149999999999999 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.510000000000005 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.66 HG11 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.209999999999994 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 75.420000000000002 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 74.150000000000006 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 74.209999999999994 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.340000000000003 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.454 ' NE2' HH21 ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 72.439999999999998 111.15 175.099 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 75.25 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.349999999999994 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . 0.454 HH21 ' NE2' ' A' ' 58' ' ' GLN . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 75.200000000000003 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.329999999999998 109.993 167.71 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 112.903 0.705 . . . . 70.329999999999998 112.903 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.230000000000004 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.519999999999996 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.219999999999999 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.109999999999999 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 75.519999999999996 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.310000000000002 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.040000000000006 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.310000000000002 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.510000000000005 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.510000000000005 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 71.239999999999995 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.340000000000003 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 72.25 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.239999999999995 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.310000000000002 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 72.030000000000001 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.200000000000003 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.200000000000003 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 74.420000000000002 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.120000000000005 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.530000000000001 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 71.129999999999995 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.299999999999997 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.310000000000002 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 74.25 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.340000000000003 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.340000000000003 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.340000000000003 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.299999999999997 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 73.319999999999993 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 73.209999999999994 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 75.219999999999999 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 72.439999999999998 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.140000000000001 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 72.450000000000003 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.319999999999993 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 74.099999999999994 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.120000000000005 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 74.140000000000001 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.329999999999998 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.319999999999993 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.530000000000001 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 74.430000000000007 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 74.239999999999995 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.530000000000001 111.605 173.758 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.189 -0.3 . . . . 74.450000000000003 110.189 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -153.41 88.84 1.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.5 0.72 . . . . 74.129999999999995 109.726 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.5 mtt 56.99 34.91 25.69 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 124.9 1.28 . . . . 72.510000000000005 111.259 -174.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.7 m -86.69 179.45 6.78 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.487 1.115 . . . . 73.439999999999998 112.132 -174.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.2 m120 60.58 41.45 15.44 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.469 1.508 . . . . 71.540000000000006 112.807 172.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -84.36 -4.92 59.18 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 115.426 -0.806 . . . . 74.540000000000006 112.099 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.41 98.25 1.12 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.023 -0.431 . . . . 52.109999999999999 112.023 173.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -66.37 107.21 1.94 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.683 0.793 . . . . 74.329999999999998 111.743 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.552 ' HZ2' ' HB3' ' A' ' 9' ' ' LYS . 9.6 mtpm? -80.65 114.67 19.7 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.244 0.617 . . . . 73.420000000000002 111.594 178.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.491 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -86.38 -25.8 25.13 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.599 0.76 . . . . 75.209999999999994 110.827 170.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -76.45 97.7 4.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.459 0.703 . . . . 70.540000000000006 111.011 176.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.6 t30 67.41 130.73 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.413 1.485 . . . . 74.549999999999997 113.537 172.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -67.05 -68.04 0.41 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.99 0.916 . . . . 61.210000000000001 110.824 177.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.1 m -109.9 118.38 36.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.448 0.699 . . . . 75.120000000000005 109.387 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.1 m -57.12 -30.3 64.28 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.241 1.016 . . . . 73.150000000000006 111.827 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -106.17 167.24 9.95 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.015 0.926 . . . . 73.239999999999995 111.248 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 64.510000000000005 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 70.549999999999997 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.340000000000003 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 73.340000000000003 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 75.230000000000004 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.140000000000001 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.010000000000005 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.319999999999993 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.406 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 74.430000000000007 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.530000000000001 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.140000000000001 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.532 ' HB3' ' HZ1' ' A' ' 30' ' ' LYS . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 75.340000000000003 111.204 172.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 73.319999999999993 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.140000000000001 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 72.319999999999993 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 71.439999999999998 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.418 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.420000000000002 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.530000000000001 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 73.530000000000001 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 74.209999999999994 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.547 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 75.099999999999994 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 73.299999999999997 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.150000000000006 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.603 HD22 HD22 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 75.420000000000002 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 73.25 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.109999999999999 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.310000000000002 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 63.439999999999998 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.109999999999999 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.439999999999998 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 75.129999999999995 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.547 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.310000000000002 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.409 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.310000000000002 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.519999999999996 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 71.299999999999997 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 74.439999999999998 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.409 HG21 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 75.030000000000001 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.340000000000003 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.209999999999994 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.230000000000004 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.414 ' OD1' ' HE2' ' A' ' 63' ' ' LYS . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.519999999999996 110.29 177.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 75.040000000000006 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.502 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 74.140000000000001 111.801 176.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.73 -44.92 88.61 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 74.450000000000003 111.167 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HE2' ' OD1' ' A' ' 59' ' ' ASN . 3.7 mptp? -65.4 -42.98 92.04 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.084 0.469 . . . . 72.540000000000006 110.647 172.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.502 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.5 t90 -60.39 -26.25 66.51 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.962 1.305 . . . . 74.400000000000006 112.109 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -61.74 -36.72 81.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.574 0.75 . . . . 74.230000000000004 112.91 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -78.08 89.96 4.22 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.099 0.476 . . . . 70.209999999999994 111.325 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -72.49 105.31 4.12 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 115.635 -0.711 . . . . 74.409999999999997 109.728 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.425 ' HG3' ' HB2' ' A' ' 70' ' ' PHE . 9.8 tp10 -86.14 -50.62 6.86 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 116.201 -0.454 . . . . 65.239999999999995 112.19 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 61.44 43.62 10.22 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.408 1.099 . . . . 74.239999999999995 110.501 -175.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.425 ' HB2' ' HG3' ' A' ' 68' ' ' GLU . 34.2 t80 -76.06 -36.64 58.92 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.114 -0.948 . . . . 73.010000000000005 112.308 -175.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.37 -173.38 36.92 Favored Glycine 0 C--N 1.348 1.217 0 N-CA-C 114.254 0.462 . . . . 72.340000000000003 114.254 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.12 -18.07 56.11 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.922 0.889 . . . . 71.450000000000003 112.786 -174.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.8 ttm -89.99 86.15 6.52 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 109.634 -0.506 . . . . 72.140000000000001 109.634 173.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 56.71 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.034 1.334 . . . . 74.409999999999997 111.457 -175.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 . . . . . 0 N--CA 1.497 1.887 0 C-N-CA 124.768 1.227 . . . . 73.140000000000001 113.92 -173.547 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.9 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.421 0.153 . . . . 73.430000000000007 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -89.28 123.97 33.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.189 0.596 . . . . 74.5 109.94 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 mmt -79.61 157.78 27.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.789 0.836 . . . . 72.340000000000003 111.867 -177.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.3 t -136.21 163.17 31.01 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.464 0.705 . . . . 73.019999999999996 111.271 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -71.33 139.14 49.76 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 123.711 0.804 . . . . 74.349999999999994 110.254 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.462 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -68.87 120.11 14.27 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.456 0.702 . . . . 73.299999999999997 111.15 -174.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.91 -29.94 9.2 Favored Glycine 0 CA--C 1.539 1.554 0 CA-C-N 116.379 -0.373 . . . . 72.409999999999997 113.267 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.81 95.15 6.59 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.533 0.733 . . . . 74.540000000000006 110.012 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -101.56 24.0 10.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.163 0.985 . . . . 75.450000000000003 111.878 -175.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.58 89.5 0.98 Allowed 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.197 0.599 . . . . 74.25 110.767 -175.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -140.05 126.2 19.85 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.2 1.0 . . . . 75.219999999999999 109.546 174.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -104.76 109.3 21.19 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.489 0.715 . . . . 74.439999999999998 110.815 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -86.22 -6.24 59.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.503 0.721 . . . . 73.409999999999997 112.19 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.2 p -81.64 -57.12 3.59 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.702 0.801 . . . . 75.510000000000005 111.672 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.0 m -127.16 135.57 50.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.124 0.97 . . . . 64.530000000000001 108.561 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 65.58 163.52 0.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.774 1.23 . . . . 75.25 111.983 -169.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.299999999999997 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 74.230000000000004 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.099999999999994 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.150000000000006 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 71.239999999999995 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.219999999999999 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.546 HD22 HD23 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.129999999999995 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.340000000000003 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 74.140000000000001 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 75.540000000000006 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 73.519999999999996 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 74.340000000000003 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 73.109999999999999 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 72.230000000000004 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.450000000000003 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 73.140000000000001 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.109999999999999 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.454 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.209999999999994 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 70.25 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 74.230000000000004 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.454 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.409999999999997 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.409999999999997 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.340000000000003 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.546 HD23 HD22 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 74.010000000000005 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.530000000000001 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 71.409999999999997 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 73.340000000000003 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.239999999999995 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.030000000000001 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.340000000000003 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.209999999999994 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.210000000000001 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 73.109999999999999 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.109999999999999 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.140000000000001 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.239999999999995 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.140000000000001 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 73.549999999999997 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 72.540000000000006 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.219999999999999 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 74.239999999999995 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 74.140000000000001 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.97 83.48 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.239999999999995 110.801 175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -74.17 -24.49 59.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.577 0.751 . . . . 73.340000000000003 112.53 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -75.1 -28.32 60.22 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.276 0.631 . . . . 64.219999999999999 110.624 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -83.1 8.58 12.56 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.77 0.828 . . . . 75.109999999999999 112.729 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -67.5 111.48 4.15 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.129 0.572 . . . . 75.239999999999995 109.905 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -83.29 151.85 25.41 Favored 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 124.443 1.097 . . . . 75.519999999999996 110.859 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 73.84 97.98 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 125.11 1.364 . . . . 63.219999999999999 112.526 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -111.39 111.29 22.23 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.138 0.975 . . . . 75.25 109.064 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.09 121.73 11.13 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.236 0.614 . . . . 74.040000000000006 111.119 -174.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.54 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.481 1.637 0 C-N-CA 123.045 0.355 . . . . 44.219999999999999 113.68 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 67.68 -83.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.786 1.634 . . . . 72.409999999999997 111.675 178.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.4 ttt 51.81 35.4 15.35 Favored 'General case' 0 CA--C 1.57 1.713 0 C-N-CA 124.125 0.97 . . . . 75.329999999999998 111.666 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -74.47 83.97 1.99 Allowed 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 115.247 -0.888 . . . . 74.349999999999994 111.501 -173.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 . . . . . 0 CA--C 1.561 1.378 0 C-N-CA 124.726 1.21 . . . . 75.409999999999997 109.065 179.054 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.499 0.19 . . . . 73.109999999999999 111.493 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -166.55 -27.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.136 0.974 . . . . 73.519999999999996 111.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -62.93 -49.09 76.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 73.510000000000005 110.345 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.9 t -114.12 136.94 52.38 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.837 0.855 . . . . 75.099999999999994 109.604 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -101.73 -48.24 4.36 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.217 0.607 . . . . 72.420000000000002 110.819 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 tptm 65.17 140.68 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 125.254 1.422 . . . . 73.319999999999993 113.697 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.05 -143.0 16.22 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.393 -0.367 . . . . 45.240000000000002 113.532 173.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.577 ' HZ3' ' HB3' ' A' ' 8' ' ' LYS . 8.4 mtpm? -73.39 145.54 45.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.266 0.626 . . . . 75.120000000000005 112.491 -177.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -155.18 141.36 18.47 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.099 0.96 . . . . 75.340000000000003 109.583 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -64.61 96.79 0.18 Allowed 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.597 0.713 . . . . 71.150000000000006 111.589 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -74.21 -24.12 59.3 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.521 1.128 . . . . 75.540000000000006 111.732 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -62.4 127.37 31.03 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.51 0.724 . . . . 62.210000000000001 111.379 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -93.75 161.04 14.49 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.254 1.022 . . . . 73.040000000000006 111.383 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.5 p -130.42 -70.67 0.61 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.193 0.597 . . . . 73.010000000000005 110.254 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.9 m -111.39 157.04 20.7 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.968 0.907 . . . . 73.019999999999996 109.329 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 67.31 -178.43 0.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.907 1.283 . . . . 72.540000000000006 111.775 -177.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 62.229999999999997 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 70.5 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.340000000000003 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 74.140000000000001 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.310000000000002 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.409999999999997 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 73.200000000000003 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.568 HD22 HD23 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.439999999999998 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.010000000000005 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.450000000000003 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.239999999999995 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.340000000000003 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.448 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.0 mm-40 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.329999999999998 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.209999999999994 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.239999999999995 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.219999999999999 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.530000000000001 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.140000000000001 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.299999999999997 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.420000000000002 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 74.5 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 64.319999999999993 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 74.319999999999993 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 74.239999999999995 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 73.120000000000005 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.568 HD23 HD22 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 74.25 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.420000000000002 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.519999999999996 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 72.299999999999997 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.329999999999998 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.010000000000005 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.099999999999994 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.200000000000003 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.407 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.519999999999996 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.099999999999994 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 75.439999999999998 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.230000000000004 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 74.400000000000006 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.418 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 73.329999999999998 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.419 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.340000000000003 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 74.319999999999993 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 75.140000000000001 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.418 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 75.209999999999994 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.329999999999998 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.89 86.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 61.539999999999999 111.721 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.423 ' HG2' HE22 ' A' ' 72' ' ' GLN . 86.2 mttt -82.94 -24.58 32.96 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.406 0.682 . . . . 75.030000000000001 111.756 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 72.0 t90 -78.26 -53.3 7.47 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.498 1.119 . . . . 73.5 111.318 -178.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -89.05 66.07 7.67 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-O 122.229 1.014 . . . . 74.150000000000006 111.275 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -137.48 144.92 42.48 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.112 0.965 . . . . 64.439999999999998 109.274 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -73.75 -40.05 63.79 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 74.030000000000001 109.798 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.65 124.42 27.91 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.527 -1.286 . . . . 75.549999999999997 107.527 160.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -161.36 -41.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.6 0.636 . . . . 74.049999999999997 112.351 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -50.36 -54.36 22.23 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 124.353 1.061 . . . . 74.439999999999998 112.259 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -113.42 72.15 0.23 Allowed Glycine 0 N--CA 1.47 0.938 0 CA-C-N 115.63 -0.714 . . . . 55.219999999999999 111.33 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.423 HE22 ' HG2' ' A' ' 63' ' ' LYS . 53.2 tt0 -66.27 111.58 3.54 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.967 0.507 . . . . 73.420000000000002 110.696 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 53.3 mtm -65.35 106.55 1.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.154 0.982 . . . . 74.549999999999997 112.144 -171.623 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -141.92 137.03 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.593 -0.892 . . . . 75.409999999999997 108.593 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.844 0.858 . . . . 72.230000000000004 112.364 -173.156 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.4 p . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.675 0.274 . . . . 64.120000000000005 111.051 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -123.83 124.29 42.34 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.776 0.83 . . . . 74.420000000000002 109.511 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.29 156.84 18.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 74.150000000000006 111.573 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.9 m -146.14 103.02 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.064 0.946 . . . . 75.200000000000003 109.04 173.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.6 p-10 -75.57 -6.42 50.2 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 113.412 0.893 . . . . 72.010000000000005 113.412 -172.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -103.68 114.04 28.01 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.771 0.829 . . . . 72.430000000000007 110.898 178.086 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.49 71.01 2.89 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 111.895 -0.482 . . . . 72.219999999999999 111.895 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -78.8 130.0 35.24 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.596 0.758 . . . . 73.319999999999993 112.197 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -75.91 106.44 7.49 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 122.953 0.501 . . . . 72.510000000000005 110.755 174.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -157.5 -76.01 0.09 Allowed 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 109.665 -0.494 . . . . 74.299999999999997 109.665 172.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -136.56 142.25 43.38 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.615 0.766 . . . . 74.310000000000002 110.478 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -96.44 60.73 1.93 Allowed 'General case' 0 CA--C 1.556 1.187 0 N-CA-C 107.852 -1.166 . . . . 74.239999999999995 107.852 166.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 64.11 10.23 5.29 Favored 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 125.37 1.468 . . . . 72.450000000000003 112.184 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.1 p -80.26 93.9 5.98 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.934 0.894 . . . . 73.030000000000001 111.73 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.7 p -94.38 1.77 55.82 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.204 0.601 . . . . 75.319999999999993 111.536 172.235 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.28 160.09 23.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.245 1.018 . . . . 74.510000000000005 111.251 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.519999999999996 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 62.340000000000003 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.150000000000006 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.439999999999998 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.340000000000003 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.319999999999993 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 72.219999999999999 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.439999999999998 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.481 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.510000000000005 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 72.209999999999994 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 62.009999999999998 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 75.150000000000006 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 64.140000000000001 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 75.219999999999999 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.76 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.430000000000007 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.150000000000006 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.400000000000006 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.219999999999999 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 74.340000000000003 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 75.430000000000007 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 73.140000000000001 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 62.229999999999997 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.319999999999993 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.505 ' HA ' ' HE1' ' A' ' 44' ' ' MET . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.319999999999993 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.666 HD23 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.030000000000001 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.505 ' HE1' ' HA ' ' A' ' 41' ' ' GLN . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 73.109999999999999 112.628 -177.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 75.230000000000004 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 74.319999999999993 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 70.129999999999995 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.230000000000004 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.310000000000002 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.219999999999999 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 74.230000000000004 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.420000000000002 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.239999999999995 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.430000000000007 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 72.310000000000002 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.230000000000004 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.299999999999997 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 73.049999999999997 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 64.340000000000003 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.329999999999998 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.76 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.409999999999997 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.67 -41.01 84.38 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.319999999999993 110.59 172.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -80.73 -27.11 36.99 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.939 0.895 . . . . 74.200000000000003 111.998 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.523 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.2 t90 -73.37 -33.81 65.25 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.531 0.732 . . . . 75.030000000000001 110.141 174.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -78.91 -30.25 44.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 74.25 111.007 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -143.25 107.84 4.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.406 0.682 . . . . 72.230000000000004 109.831 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.7 ttp180 -43.99 -61.95 1.29 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.838 1.655 . . . . 72.319999999999993 114.359 -171.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 55.96 65.87 1.34 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.65 1.18 . . . . 75.109999999999999 112.925 -175.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -171.06 103.07 0.22 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.845 -1.07 . . . . 74.230000000000004 109.902 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -94.19 -17.5 22.66 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.444 0.698 . . . . 72.239999999999995 111.518 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.08 -107.26 3.42 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 116.307 -0.406 . . . . 64.420000000000002 112.855 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -125.68 136.85 53.67 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.792 0.837 . . . . 52.109999999999999 111.198 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 83.2 mtp -77.68 99.35 5.79 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.343 0.657 . . . . 73.010000000000005 110.483 173.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -86.38 96.39 9.99 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.275 0.63 . . . . 73.120000000000005 111.504 -176.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 124.447 1.099 . . . . 71.120000000000005 110.038 170.751 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.597 0.237 . . . . 71.230000000000004 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.29 162.76 26.53 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.312 0.645 . . . . 75.450000000000003 112.109 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 47.1 ttp 72.35 -1.75 2.83 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.954 1.301 . . . . 75.150000000000006 112.297 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -115.37 83.49 1.93 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.874 0.869 . . . . 75.319999999999993 109.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -111.36 95.15 5.34 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.772 0.829 . . . . 73.049999999999997 110.868 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -153.7 135.41 14.46 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.02 0.928 . . . . 73.310000000000002 109.321 175.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.43 165.89 51.47 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 121.605 -0.331 . . . . 52.299999999999997 112.553 171.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 63.84 96.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.661 1.185 . . . . 74.510000000000005 112.559 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -96.93 139.3 33.17 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.437 0.695 . . . . 72.230000000000004 110.246 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -146.75 -64.51 0.29 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 122.143 -0.348 . . . . 75.409999999999997 111.743 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -83.24 -1.39 53.0 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 122.975 0.51 . . . . 74.420000000000002 112.024 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -62.58 142.7 57.88 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.384 0.674 . . . . 75.109999999999999 112.086 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -66.92 100.16 0.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.182 0.593 . . . . 74.230000000000004 111.227 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.8 m -101.03 -47.94 4.59 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.417 -0.811 . . . . 75.340000000000003 111.514 -174.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.9 p -96.58 -62.45 1.27 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.464 0.706 . . . . 75.299999999999997 111.266 -176.225 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -97.84 135.2 39.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.631 0.772 . . . . 70.239999999999995 110.01 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.239999999999995 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.219999999999999 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 75.019999999999996 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.019999999999996 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 72.319999999999993 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.219999999999999 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 74.310000000000002 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.049999999999997 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.464 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 65.430000000000007 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 73.519999999999996 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 74.219999999999999 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.409999999999997 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.464 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.420000000000002 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 75.299999999999997 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.150000000000006 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 75.099999999999994 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 72.329999999999998 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.49 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 71.099999999999994 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.462 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 72.030000000000001 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.310000000000002 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.200000000000003 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.49 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 74.219999999999999 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 74.329999999999998 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.401 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 29.1 mm-40 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 72.129999999999995 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.420000000000002 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.310000000000002 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.430000000000007 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.530000000000001 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.340000000000003 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.409999999999997 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.129999999999995 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 71.319999999999993 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.209999999999994 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 74.109999999999999 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 75.420000000000002 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.349999999999994 110.663 172.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 75.340000000000003 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.409999999999997 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.417 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.109999999999999 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 73.329999999999998 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.239999999999995 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.510000000000005 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 74.420000000000002 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.82 85.59 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.009999999999998 111.794 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.26 -25.22 34.27 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.085 0.554 . . . . 74.540000000000006 110.807 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.2 t90 -68.36 -30.25 69.15 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.056 0.942 . . . . 74.319999999999993 111.196 168.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -73.71 117.85 15.97 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.798 0.839 . . . . 70.340000000000003 109.959 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -67.0 133.91 50.89 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.022 0.529 . . . . 75.439999999999998 112.249 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 60.93 97.12 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 125.121 1.368 . . . . 72.219999999999999 111.616 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.11 122.56 18.54 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.729 -0.669 . . . . 64.129999999999995 110.021 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -59.03 97.47 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.669 0.788 . . . . 72.329999999999998 111.045 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 t80 56.95 45.34 21.44 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 124.576 1.15 . . . . 75.310000000000002 111.22 -174.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.28 -74.59 1.1 Allowed Glycine 0 C--N 1.351 1.376 0 CA-C-N 115.794 -0.639 . . . . 62.340000000000003 112.599 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.71 4.05 50.06 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.345 0.658 . . . . 74.030000000000001 112.134 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.3 mtm 68.67 143.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.406 1.482 . . . . 73.239999999999995 112.477 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 66.04 106.47 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.471 1.108 . . . . 73.439999999999998 112.056 176.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.573 1.835 0 C-N-CA 124.494 1.117 . . . . 74.200000000000003 111.879 -173.744 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.467 0.175 . . . . 73.099999999999994 111.168 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -101.72 132.5 47.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.468 0.707 . . . . 75.049999999999997 109.736 175.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -64.93 123.54 19.71 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.225 0.61 . . . . 75.439999999999998 110.84 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.5 p -80.41 92.34 5.82 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.346 0.658 . . . . 71.420000000000002 111.405 -175.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -107.26 96.38 6.38 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.407 0.683 . . . . 74.019999999999996 109.813 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -114.48 115.48 27.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.704 0.802 . . . . 65.099999999999994 109.043 176.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.54 51.04 4.11 Favored Glycine 0 N--CA 1.479 1.559 0 N-CA-C 114.338 0.495 . . . . 74.129999999999995 114.338 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -99.73 84.85 2.99 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.574 0.75 . . . . 71.400000000000006 109.326 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.621 ' HZ2' ' HB3' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -72.25 110.76 6.91 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.992 0.917 . . . . 74.120000000000005 109.085 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 63.4 mtt-85 -91.96 -93.52 0.14 Allowed 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 122.953 0.501 . . . . 74.239999999999995 110.051 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 174.77 141.54 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.273 1.429 . . . . 72.420000000000002 109.945 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.82 130.42 36.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.096 0.558 . . . . 73.530000000000001 110.441 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.6 ttp180 -89.45 121.54 31.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.822 -0.807 . . . . 74.329999999999998 108.822 173.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.7 p -66.42 101.84 0.8 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.516 0.726 . . . . 74.25 111.893 -171.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.7 p -73.91 121.3 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.062 0.945 . . . . 64.420000000000002 110.923 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 60.77 -165.62 0.21 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 124.119 0.967 . . . . 74.340000000000003 111.364 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.120000000000005 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.120000000000005 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.403 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.540000000000006 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 74.329999999999998 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.474 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 74.219999999999999 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.409999999999997 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.463 HD23 HD23 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 72.409999999999997 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.502 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.209999999999994 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 71.420000000000002 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.400000000000006 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.443 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.120000000000005 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.239999999999995 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 72.510000000000005 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 73.120000000000005 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 72.209999999999994 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.540000000000006 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.030000000000001 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 64.510000000000005 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 74.340000000000003 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 73.299999999999997 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.209999999999994 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.430000000000007 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 75.430000000000007 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.463 HD23 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 74.209999999999994 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.150000000000006 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 74.109999999999999 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.310000000000002 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.403 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 75.519999999999996 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 72.120000000000005 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 70.25 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 74.150000000000006 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.219999999999999 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 71.540000000000006 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.430000000000007 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 73.239999999999995 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 75.099999999999994 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 72.319999999999993 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 75.030000000000001 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.57 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 74.430000000000007 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 30.4 mm-40 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.150000000000006 110.933 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.406 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.430000000000007 110.225 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.099999999999994 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.57 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.310000000000002 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.46 69.04 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 73.420000000000002 111.134 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.406 ' HG3' ' O ' ' A' ' 59' ' ' ASN . 64.2 mttm -84.07 -30.61 25.89 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.85 0.86 . . . . 74.420000000000002 111.635 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -65.72 -46.35 79.26 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.774 0.829 . . . . 74.299999999999997 111.337 -172.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -81.26 164.61 22.12 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 109.552 -0.536 . . . . 74.319999999999993 109.552 172.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -76.83 80.19 3.42 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.676 0.75 . . . . 72.209999999999994 112.855 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -102.51 125.34 49.2 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.656 1.183 . . . . 73.519999999999996 109.439 171.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -90.67 -58.07 2.61 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.164 0.586 . . . . 73.439999999999998 111.126 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -148.23 -37.15 0.19 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.203 0.601 . . . . 75.129999999999995 111.849 -172.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -60.6 126.44 27.45 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.621 0.769 . . . . 63.310000000000002 111.639 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.1 16.56 3.53 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 115.924 -0.58 . . . . 73.340000000000003 112.675 -172.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -83.85 137.17 33.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.37 0.668 . . . . 75.120000000000005 111.904 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.2 ptt? -157.34 118.53 3.63 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.104 0.961 . . . . 72.329999999999998 109.488 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -86.87 -63.8 1.25 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 120.962 0.411 . . . . 75.430000000000007 111.114 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 . . . . . 0 CA--C 1.562 1.423 0 C-N-CA 123.784 0.834 . . . . 75.299999999999997 111.246 -176.307 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.794 0.33 . . . . 72.349999999999994 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -161.47 101.05 1.19 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.706 0.802 . . . . 75.25 109.461 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.6 ptm -104.56 114.53 28.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.182 0.593 . . . . 72.140000000000001 110.774 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.7 m -135.65 131.23 35.5 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.501 0.72 . . . . 74.209999999999994 110.559 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -77.73 160.32 28.5 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 121.241 0.543 . . . . 73.219999999999999 111.592 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 95.49 7.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.78 0.832 . . . . 72.340000000000003 109.858 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.55 73.05 2.29 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 116.27 -0.423 . . . . 74.450000000000003 112.709 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -115.71 151.47 35.03 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.816 0.846 . . . . 74.450000000000003 112.039 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -104.05 116.36 32.09 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.553 0.741 . . . . 73.129999999999995 110.14 177.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -91.63 153.77 19.48 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.435 0.694 . . . . 74.400000000000006 112.305 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtm105 -81.3 109.78 16.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.874 0.87 . . . . 75.299999999999997 110.629 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -99.02 -13.49 19.86 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.988 0.515 . . . . 74.409999999999997 111.53 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 -67.73 0.97 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.593 0.757 . . . . 73.340000000000003 109.222 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.5 m 67.48 93.49 0.07 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.155 1.382 . . . . 74.420000000000002 112.217 -172.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.1 m -139.56 -54.59 0.56 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.625 1.17 . . . . 65.299999999999997 107.843 167.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 -115.14 141.57 47.83 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 114.389 -1.278 . . . . 75.439999999999998 108.509 170.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 61.509999999999998 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.49 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.310000000000002 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.219999999999999 111.14 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 73.0 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.239999999999995 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 55.5 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.4 HD23 HD23 ' A' ' 42' ' ' LEU . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.329999999999998 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.435 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 74.109999999999999 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 75.319999999999993 110.926 173.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 74.519999999999996 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 72.409999999999997 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.435 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.230000000000004 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 75.010000000000005 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.129999999999995 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 70.409999999999997 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.099999999999994 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.219999999999999 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.120000000000005 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 74.349999999999994 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 70.120000000000005 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.703 HH11 HG11 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 73.239999999999995 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.420000000000002 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.437 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 74.409999999999997 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.4 HD23 HD23 ' A' ' 24' ' ' LEU . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 70.319999999999993 112.264 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 65.209999999999994 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.450000000000003 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.329999999999998 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.430000000000007 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 75.299999999999997 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.239999999999995 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 73.530000000000001 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.443 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 73.420000000000002 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 75.540000000000006 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.438 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 75.340000000000003 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.703 HG11 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 74.349999999999994 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 70.230000000000004 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.530000000000001 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.329999999999998 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 74.430000000000007 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.019999999999996 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 73.400000000000006 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 75.349999999999994 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.400000000000006 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.44 84.91 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.539999999999999 111.317 173.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -73.75 -25.77 60.33 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.582 0.753 . . . . 74.519999999999996 111.466 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -70.89 -49.16 48.94 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.207 0.603 . . . . 74.109999999999999 110.735 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 30.3 mtm-85 -71.06 115.87 10.7 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.371 0.669 . . . . 73.430000000000007 111.053 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -71.49 123.79 23.2 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 123.192 0.597 . . . . 74.310000000000002 112.446 -174.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.49 25.21 14.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.617 1.567 . . . . 75.420000000000002 113.07 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -74.46 155.76 37.67 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.584 0.754 . . . . 74.0 110.588 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 73.58 118.35 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 125.299 1.44 . . . . 73.230000000000004 111.317 -172.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -135.27 152.92 51.96 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.705 0.802 . . . . 73.450000000000003 110.918 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.9 73.08 2.35 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 116.357 -0.383 . . . . 62.520000000000003 114.037 -175.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -91.38 115.25 27.88 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.498 0.719 . . . . 75.040000000000006 110.593 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.58 67.32 0.76 Allowed 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.351 -0.981 . . . . 70.450000000000003 108.351 171.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -99.86 97.52 8.41 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.966 0.906 . . . . 64.239999999999995 110.401 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.258 1.521 0 C-N-CA 123.397 0.679 . . . . 74.450000000000003 109.801 175.45 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 81.1 p . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.934 -0.079 . . . . 74.209999999999994 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -164.35 -29.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.362 0.665 . . . . 73.400000000000006 111.601 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -64.61 140.7 58.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.105 0.562 . . . . 72.099999999999994 111.919 -177.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.4 m -93.77 -38.52 11.23 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.685 0.794 . . . . 64.299999999999997 111.086 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.73 100.27 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 124.65 1.18 . . . . 74.239999999999995 112.289 176.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.93 90.28 1.93 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.475 0.71 . . . . 74.439999999999998 109.22 177.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.49 72.68 0.09 OUTLIER Glycine 0 N--CA 1.471 1.002 0 CA-C-N 115.716 -0.675 . . . . 72.129999999999995 111.531 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -55.67 -52.4 63.97 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.245 1.018 . . . . 74.439999999999998 111.534 -175.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt 60.97 93.45 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 124.322 1.049 . . . . 75.530000000000001 111.75 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -67.59 -16.11 64.01 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.646 1.179 . . . . 75.120000000000005 113.721 -173.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.8 ttt180 -70.22 -77.66 0.08 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.455 0.702 . . . . 74.109999999999999 112.855 -170.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -92.16 138.74 31.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.357 0.663 . . . . 74.430000000000007 111.25 -174.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -85.07 74.0 10.57 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.611 0.765 . . . . 74.400000000000006 110.436 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.3 m -70.75 87.91 0.7 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.835 0.854 . . . . 75.549999999999997 109.737 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.1 t -109.56 18.4 20.36 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.28 1.032 . . . . 74.5 111.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -75.8 124.52 27.44 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.526 0.73 . . . . 75.340000000000003 110.913 -175.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.409999999999997 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.340000000000003 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.510000000000005 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 74.439999999999998 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 73.439999999999998 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.019999999999996 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 72.150000000000006 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 73.129999999999995 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.518 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 63.149999999999999 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.219999999999999 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.230000000000004 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 63.539999999999999 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.518 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.409999999999997 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.340000000000003 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 71.230000000000004 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 54.409999999999997 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.530000000000001 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.510000000000005 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.549999999999997 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 72.219999999999999 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.129999999999995 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.400000000000006 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 75.239999999999995 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 63.210000000000001 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 75.209999999999994 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.475 HD22 HD22 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.510000000000005 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 74.209999999999994 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.229999999999997 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 73.340000000000003 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.450000000000003 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.420000000000002 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 63.439999999999998 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 74.230000000000004 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 74.310000000000002 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.200000000000003 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.209999999999994 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.432 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 73.549999999999997 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 73.549999999999997 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 74.0 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.400000000000006 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.329999999999998 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.310000000000002 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.319999999999993 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.400000000000006 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 74.310000000000002 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.68 -48.04 78.76 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 74.540000000000006 110.696 175.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.41 -31.66 72.02 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.802 0.841 . . . . 75.540000000000006 112.202 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -68.77 -36.36 78.23 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.928 0.891 . . . . 74.109999999999999 110.861 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.42 -52.69 24.46 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 116.256 -0.429 . . . . 74.409999999999997 110.1 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -164.96 -61.86 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 115.973 -0.558 . . . . 71.239999999999995 111.04 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -161.72 164.42 29.06 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.54 0.736 . . . . 64.310000000000002 111.52 -171.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -109.1 -26.62 10.05 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 114.298 1.222 . . . . 75.030000000000001 114.298 -169.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -65.82 -27.17 68.05 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 113.081 0.771 . . . . 71.439999999999998 113.081 -170.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -78.38 1.51 21.76 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 123.486 0.714 . . . . 73.340000000000003 112.244 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.18 110.52 3.49 Favored Glycine 0 C--N 1.358 1.787 0 C-N-CA 122.916 0.293 . . . . 65.219999999999999 113.24 176.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -74.16 134.95 42.82 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.545 0.738 . . . . 63.009999999999998 112.595 -170.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -143.19 155.42 44.54 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.693 0.797 . . . . 75.400000000000006 111.057 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -89.97 110.22 21.21 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.003 0.521 . . . . 54.229999999999997 110.107 176.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 . . . . . 0 CA--C 1.574 1.88 0 C-N-CA 124.999 1.319 . . . . 71.109999999999999 112.675 179.357 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 110.406 -0.22 . . . . 75.0 110.406 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 26.1 p80 -62.46 145.98 52.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.988 0.515 . . . . 75.109999999999999 111.837 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.45 116.9 13.73 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 108.837 -0.801 . . . . 62.25 108.837 173.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -106.66 135.03 48.89 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.139 0.976 . . . . 74.439999999999998 110.378 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -117.79 122.07 42.46 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.644 0.778 . . . . 73.150000000000006 110.555 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.01 78.67 3.55 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.374 0.607 . . . . 75.010000000000005 110.513 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.39 177.39 45.35 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.635 -0.711 . . . . 55.420000000000002 112.866 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt 59.27 29.06 18.56 Favored 'General case' 0 N--CA 1.497 1.925 0 C-N-CA 124.037 0.935 . . . . 75.010000000000005 111.925 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -77.96 17.72 0.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.509 1.124 . . . . 72.540000000000006 113.699 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.2 ttt180 -76.92 -9.59 58.79 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 122.947 0.499 . . . . 74.150000000000006 110.758 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.1 mmt180 -84.76 87.52 7.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.563 0.745 . . . . 72.0 111.404 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -100.3 119.9 39.11 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.592 0.757 . . . . 75.010000000000005 109.281 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.3 ttt-85 -124.56 135.75 53.41 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.186 0.594 . . . . 74.510000000000005 110.268 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -87.92 61.15 6.23 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.769 0.828 . . . . 74.5 111.562 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -77.22 84.0 3.69 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.415 0.686 . . . . 63.310000000000002 109.722 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 62.06 -179.83 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.749 1.219 . . . . 71.120000000000005 112.235 -175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 72.310000000000002 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 71.420000000000002 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.439999999999998 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.530000000000001 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.430000000000007 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.340000000000003 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.420000000000002 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.478 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 72.340000000000003 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 73.510000000000005 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.150000000000006 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 74.430000000000007 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 73.400000000000006 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 70.519999999999996 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 73.439999999999998 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 74.299999999999997 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.430000000000007 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.329999999999998 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.475 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.409999999999997 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 73.230000000000004 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.230000000000004 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.446 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 75.200000000000003 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 73.040000000000006 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.019999999999996 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 70.120000000000005 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.010000000000005 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.349999999999994 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 74.430000000000007 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.430000000000007 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.450000000000003 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 75.519999999999996 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 71.150000000000006 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 73.409999999999997 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.420000000000002 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 64.299999999999997 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.340000000000003 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 72.349999999999994 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.450000000000003 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 75.019999999999996 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 74.5 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.530000000000001 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.430000000000007 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.27 90.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 74.310000000000002 111.34 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.78 -31.56 25.84 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.988 0.915 . . . . 74.030000000000001 111.937 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -71.54 -34.69 70.25 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.525 1.13 . . . . 70.030000000000001 111.363 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.03 -34.57 77.85 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.812 0.845 . . . . 74.200000000000003 111.893 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -146.05 93.5 2.34 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.143 0.577 . . . . 74.340000000000003 110.488 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -93.76 126.29 38.86 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.062 0.545 . . . . 75.219999999999999 110.512 176.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -159.66 -170.52 2.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.85 0.86 . . . . 71.310000000000002 110.69 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -75.87 177.76 6.72 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.32 0.648 . . . . 74.310000000000002 111.626 176.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -66.96 -43.71 82.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.46 0.304 . . . . 74.25 111.575 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.54 136.49 6.59 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-N 116.142 -0.481 . . . . 74.230000000000004 113.089 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.61 83.47 1.29 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 108.742 -0.836 . . . . 75.209999999999994 108.742 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 ttm -157.14 -53.98 0.08 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.024 0.929 . . . . 72.340000000000003 109.699 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -142.6 80.91 1.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.658 0.742 . . . . 75.310000000000002 109.682 174.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 . . . . . 0 CA--C 1.566 1.579 0 CA-C-N 115.167 -0.924 . . . . 72.5 108.972 172.464 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.669 0.271 . . . . 55.240000000000002 111.616 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.2 160.03 39.68 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.468 0.707 . . . . 75.530000000000001 111.507 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 51.2 tpp -152.72 150.87 29.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.976 0.511 . . . . 72.439999999999998 111.427 -176.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.3 p -88.21 -173.12 4.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.165 0.986 . . . . 70.439999999999998 112.204 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -62.99 110.95 1.96 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.834 0.454 . . . . 75.129999999999995 110.712 171.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -83.32 60.14 5.42 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.18 0.992 . . . . 74.310000000000002 112.102 -173.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 71.42 -73.28 0.75 Allowed Glycine 0 CA--C 1.537 1.456 0 N-CA-C 114.045 0.378 . . . . 64.450000000000003 114.045 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.659 ' HB2' ' HZ3' ' A' ' 8' ' ' LYS . 8.6 mtmp? 68.32 82.1 0.18 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.088 1.355 . . . . 74.530000000000001 111.583 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.1 22.17 0.43 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.405 0.682 . . . . 74.430000000000007 111.26 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp-105 -92.7 120.32 32.98 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.537 0.735 . . . . 74.430000000000007 111.709 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 ptt180 -86.6 135.81 33.29 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.852 0.461 . . . . 75.129999999999995 110.791 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.0 172.14 11.54 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.378 0.671 . . . . 75.129999999999995 112.313 -175.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -158.09 66.87 0.47 Allowed 'General case' 0 CA--C 1.557 1.237 0 CA-C-O 121.56 0.695 . . . . 72.450000000000003 112.375 -173.065 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.3 p -134.66 75.1 1.56 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.709 -0.619 . . . . 75.129999999999995 111.327 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -77.41 -58.64 3.16 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.26 0.624 . . . . 63.119999999999997 110.927 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 66.16 153.85 0.08 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.257 1.423 . . . . 74.530000000000001 112.899 -176.322 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 71.519999999999996 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 70.430000000000007 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.409999999999997 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.6 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.510000000000005 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HD11 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 74.329999999999998 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.150000000000006 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.099999999999994 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.525 HD21 HD23 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 73.439999999999998 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.443 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.150000000000006 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 73.439999999999998 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.349999999999994 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.439999999999998 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.409999999999997 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 65.230000000000004 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.420000000000002 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.409999999999997 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.409999999999997 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 74.129999999999995 113.739 178.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.019999999999996 112.512 -179.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.407 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.540000000000006 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 72.310000000000002 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 70.200000000000003 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 72.349999999999994 111.231 176.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.409999999999997 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 74.530000000000001 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.525 HD23 HD21 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.140000000000001 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 75.150000000000006 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 72.439999999999998 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 71.420000000000002 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.6 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 74.109999999999999 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 75.219999999999999 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.4 HD21 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.409999999999997 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.230000000000004 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.411 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.409999999999997 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.4 ' HD3' HD21 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 72.450000000000003 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 75.400000000000006 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.4 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.430000000000007 112.468 177.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.140000000000001 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 75.510000000000005 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 73.439999999999998 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.412 HE22 ' NH2' ' A' ' 61' ' ' ARG . 26.5 mm-40 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.230000000000004 109.951 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.420000000000002 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 74.209999999999994 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.412 ' NH2' HE22 ' A' ' 58' ' ' GLN . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.409999999999997 111.875 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.94 86.95 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 72.349999999999994 110.559 172.064 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -72.63 -30.24 64.16 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.715 0.806 . . . . 72.549999999999997 111.875 174.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.1 t90 -62.2 -36.86 83.23 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.284 0.634 . . . . 62.439999999999998 110.485 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -88.17 167.4 13.64 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.432 0.693 . . . . 75.310000000000002 111.283 172.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.597 ' HZ1' ' HB2' ' A' ' 66' ' ' LYS . 0.0 OUTLIER -83.63 -15.21 49.86 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 114.082 1.141 . . . . 72.319999999999993 114.082 -172.136 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.473 ' HG3' ' HG3' ' A' ' 66' ' ' LYS . 99.5 mtt180 -123.76 133.86 53.76 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 112.392 0.515 . . . . 75.239999999999995 112.392 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -85.72 -49.46 7.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.465 1.106 . . . . 73.310000000000002 108.874 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -98.0 122.9 41.69 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.869 -1.059 . . . . 74.25 108.306 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -58.46 -47.21 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 112.875 0.694 . . . . 72.299999999999997 112.875 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 172.04 83.15 0.05 OUTLIER Glycine 0 CA--C 1.529 0.909 0 CA-C-N 116.593 -0.276 . . . . 70.340000000000003 112.462 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -148.85 157.42 43.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.185 0.594 . . . . 74.010000000000005 111.56 -176.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.9 ttt -143.65 138.08 28.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.719 0.808 . . . . 71.099999999999994 110.411 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -147.34 34.38 0.88 Allowed 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.855 0.862 . . . . 70.329999999999998 109.269 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 . . . . . 0 CA--C 1.576 1.977 0 C-N-CA 125.199 1.399 . . . . 74.140000000000001 112.877 -179.405 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.453 0.168 . . . . 73.239999999999995 111.188 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -151.73 143.85 23.93 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.034 0.534 . . . . 73.209999999999994 111.132 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -76.23 117.19 17.66 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.102 0.561 . . . . 75.120000000000005 111.03 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.2 t -170.86 172.61 5.54 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.958 0.903 . . . . 72.400000000000006 110.59 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -75.7 95.79 3.48 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.855 0.462 . . . . 75.510000000000005 109.78 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -124.07 61.38 1.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.078 0.951 . . . . 74.340000000000003 111.914 -172.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.67 62.99 3.63 Favored Glycine 0 N--CA 1.477 1.38 0 CA-C-N 115.71 -0.677 . . . . 72.340000000000003 112.465 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -85.49 100.29 11.79 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.341 0.656 . . . . 72.340000000000003 111.408 -175.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -137.8 104.3 5.25 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.316 0.646 . . . . 73.219999999999999 111.212 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 62.98 123.07 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.599 1.56 . . . . 72.439999999999998 113.759 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -80.5 100.8 8.72 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.36 0.664 . . . . 73.129999999999995 112.239 -176.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -102.86 -80.15 0.52 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.235 -1.024 . . . . 63.409999999999997 108.235 165.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtt-85 -135.84 50.94 2.07 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.571 1.148 . . . . 73.209999999999994 109.186 171.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -93.34 79.59 4.42 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.938 0.875 . . . . 73.219999999999999 110.871 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -116.76 -60.52 1.84 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.138 0.975 . . . . 72.409999999999997 111.324 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -122.99 129.88 52.09 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.482 0.713 . . . . 75.430000000000007 111.529 -177.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 73.400000000000006 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 61.229999999999997 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 74.310000000000002 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 75.540000000000006 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.329999999999998 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.209999999999994 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 64.150000000000006 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 42' ' ' LEU . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 64.340000000000003 111.128 176.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.120000000000005 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.619 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 74.129999999999995 111.816 178.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.329999999999998 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 74.120000000000005 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.349999999999994 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.019999999999996 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.030000000000001 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 72.349999999999994 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 74.540000000000006 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.129999999999995 112.924 -176.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.519999999999996 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 72.200000000000003 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.310000000000002 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.129999999999995 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 74.230000000000004 111.385 178.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.310000000000002 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 74.099999999999994 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.402 HD23 HD23 ' A' ' 24' ' ' LEU . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 65.299999999999997 110.964 175.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 74.519999999999996 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 72.340000000000003 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.120000000000005 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.614 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 75.319999999999993 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.340000000000003 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 72.030000000000001 112.079 -178.247 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 65.239999999999995 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.430000000000007 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.420000000000002 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.420000000000002 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 75.129999999999995 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.420000000000002 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 71.120000000000005 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.120000000000005 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.310000000000002 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.150000000000006 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 64.150000000000006 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.349999999999994 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 75.129999999999995 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.38 70.44 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 75.109999999999999 111.491 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -80.91 -49.32 11.16 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.902 0.881 . . . . 72.310000000000002 111.181 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -70.27 -54.98 10.38 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.571 1.149 . . . . 74.230000000000004 111.815 -173.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -73.4 86.81 1.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.917 0.487 . . . . 72.239999999999995 109.743 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -144.26 114.8 7.63 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.164 0.586 . . . . 72.120000000000005 110.967 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -90.38 -20.79 22.43 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.348 1.059 . . . . 74.209999999999994 111.358 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 80.65 144.93 0.08 Allowed 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 126.068 1.747 . . . . 74.349999999999994 111.0 -163.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -106.84 167.81 9.62 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.822 0.849 . . . . 73.420000000000002 111.674 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -77.03 156.23 31.97 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.487 -0.779 . . . . 75.0 109.48 165.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -85.29 -114.91 0.77 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.367 -0.293 . . . . 71.129999999999995 112.367 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -166.16 -52.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.997 0.919 . . . . 75.010000000000005 109.473 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.4 ttm -155.07 -47.08 0.08 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.057 0.543 . . . . 74.439999999999998 110.679 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.2 60.6 3.11 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.178 0.991 . . . . 53.539999999999999 111.088 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 CA--C 1.571 1.773 0 CA-C-N 114.34 -1.3 . . . . 72.049999999999997 111.737 -176.831 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 121.093 0.473 . . . . 73.230000000000004 110.661 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -79.99 130.97 35.69 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.139 0.576 . . . . 75.420000000000002 110.188 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.68 -165.34 1.94 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.241 0.616 . . . . 72.439999999999998 111.397 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m 73.67 4.56 4.75 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.129 1.371 . . . . 72.510000000000005 113.711 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -79.81 101.92 8.78 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.95 0.5 . . . . 74.329999999999998 111.416 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -130.36 93.2 3.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.894 0.877 . . . . 73.239999999999995 110.089 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.88 -165.87 26.81 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.653 -0.703 . . . . 43.219999999999999 113.066 176.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.37 117.62 22.57 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.875 0.47 . . . . 75.319999999999993 110.532 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -85.58 31.45 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.652 0.781 . . . . 74.409999999999997 111.223 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -79.38 100.33 7.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.109 0.963 . . . . 71.329999999999998 110.312 -174.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -73.29 78.27 1.33 Allowed 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 121.385 0.612 . . . . 74.450000000000003 109.951 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -79.12 93.16 5.13 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.762 -0.653 . . . . 74.230000000000004 110.58 -177.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -146.45 71.61 1.25 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.435 -0.95 . . . . 72.409999999999997 108.435 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.3 t -155.85 9.55 0.27 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 114.833 -1.076 . . . . 73.340000000000003 111.089 -178.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.7 m -111.28 -67.22 1.01 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.151 0.98 . . . . 71.349999999999994 111.566 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -88.16 132.48 34.32 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.419 0.688 . . . . 73.109999999999999 111.238 -175.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 71.120000000000005 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 63.119999999999997 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.109999999999999 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.534 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.150000000000006 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 64.209999999999994 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.414 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.140000000000001 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 73.420000000000002 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.569 HD23 HD23 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.329999999999998 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 64.219999999999999 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 65.209999999999994 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 74.109999999999999 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.472 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.109999999999999 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.040000000000006 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.219999999999999 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 74.140000000000001 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.319999999999993 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.648 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.310000000000002 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.319999999999993 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 75.200000000000003 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.420000000000002 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 74.239999999999995 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.510000000000005 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 75.430000000000007 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 73.349999999999994 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.569 HD23 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 62.240000000000002 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 74.439999999999998 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.409999999999997 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 74.530000000000001 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.534 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 73.450000000000003 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.120000000000005 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . 0.638 HD21 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.140000000000001 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 74.439999999999998 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 74.0 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.310000000000002 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.638 ' HG2' HD21 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.209999999999994 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.040000000000006 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.447 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.540000000000006 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 73.25 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.030000000000001 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.040000000000006 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.409999999999997 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 70.340000000000003 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.540000000000006 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.648 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.319999999999993 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.67 -39.92 90.2 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 74.420000000000002 111.518 177.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -79.54 -32.61 42.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.812 0.445 . . . . 74.140000000000001 111.472 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -60.46 -38.69 85.0 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.205 0.602 . . . . 65.540000000000006 110.609 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -93.23 -18.37 22.58 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.49 0.716 . . . . 73.420000000000002 111.567 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.7 pttp 40.14 56.06 2.6 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 126.488 1.915 . . . . 64.439999999999998 113.642 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -100.72 132.31 46.18 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 114.365 -1.289 . . . . 72.209999999999994 111.615 -175.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -66.08 131.89 47.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.941 0.496 . . . . 73.400000000000006 110.133 169.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -155.48 89.25 1.18 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.16 0.584 . . . . 75.329999999999998 110.17 -173.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -64.47 138.95 58.69 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.51 0.724 . . . . 74.519999999999996 111.855 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -91.71 148.45 19.26 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.359 -0.382 . . . . 73.549999999999997 113.849 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -106.76 31.53 5.21 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 124.367 1.067 . . . . 73.209999999999994 111.243 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 50.3 ttm -63.99 95.89 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.451 0.7 . . . . 74.510000000000005 112.649 -171.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -94.63 129.68 41.4 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.509 1.124 . . . . 74.540000000000006 110.38 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.491 1.578 0 C-N-CA 123.465 0.706 . . . . 75.329999999999998 111.898 -178.72 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.274 -0.269 . . . . 62.219999999999999 110.274 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -113.8 -43.91 3.23 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.12 0.568 . . . . 72.140000000000001 111.901 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 ptp -158.9 29.7 0.22 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.857 0.863 . . . . 74.140000000000001 112.659 -178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -77.56 81.41 4.02 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.28 0.562 . . . . 61.32 110.304 174.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -75.04 -29.86 60.9 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.991 0.916 . . . . 75.319999999999993 112.643 -171.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -82.18 -0.12 43.53 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.152 0.581 . . . . 72.430000000000007 112.498 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 73.41 43.93 35.86 Favored Glycine 0 C--N 1.352 1.461 0 N-CA-C 114.719 0.647 . . . . 73.200000000000003 114.719 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -106.79 122.21 45.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.939 0.496 . . . . 75.239999999999995 110.408 169.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -62.67 -39.33 93.59 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.504 1.122 . . . . 72.540000000000006 112.224 -177.253 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 61.11 175.15 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.073 1.349 . . . . 75.219999999999999 113.032 -175.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.4 ttm105 -76.06 130.15 37.91 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.363 -0.606 . . . . 75.150000000000006 109.363 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -67.63 141.96 56.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.969 0.414 . . . . 74.340000000000003 111.47 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -89.04 131.13 35.35 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.857 0.863 . . . . 73.299999999999997 110.309 -170.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 36.1 m -68.37 118.22 11.16 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.224 0.61 . . . . 71.129999999999995 110.7 176.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -94.12 -67.95 0.83 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.061 0.545 . . . . 72.230000000000004 111.061 -176.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -110.14 161.4 15.6 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.149 0.58 . . . . 72.219999999999999 112.438 -172.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 75.230000000000004 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.230000000000004 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 75.219999999999999 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.519999999999996 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.219999999999999 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.099999999999994 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.469 HD22 HD22 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 73.239999999999995 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.467 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 72.530000000000001 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 75.310000000000002 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.523 HG22 HD11 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.420000000000002 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.417 ' HB2' ' HZ3' ' A' ' 56' ' ' TRP . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.109999999999999 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 72.0 mm-40 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.140000000000001 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 73.439999999999998 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 74.530000000000001 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 74.129999999999995 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.530000000000001 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.319999999999993 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.239999999999995 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.120000000000005 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.540000000000006 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 75.239999999999995 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.523 HD11 HG22 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 75.319999999999993 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 74.030000000000001 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 74.349999999999994 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.439999999999998 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.040000000000006 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 73.549999999999997 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.150000000000006 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.140000000000001 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.530000000000001 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.43 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 74.120000000000005 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.329999999999998 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 74.329999999999998 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.400000000000006 112.251 179.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.43 HG21 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 72.420000000000002 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . 0.417 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.439999999999998 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.519999999999996 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' GLN . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 64.400000000000006 111.429 178.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 75.109999999999999 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.099999999999994 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.402 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.530000000000001 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.08 -46.54 86.95 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 74.450000000000003 111.776 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.03 -24.47 37.86 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.816 0.446 . . . . 74.310000000000002 111.387 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -61.15 -32.55 72.27 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 110.97 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -68.66 122.0 17.61 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.34 -0.846 . . . . 75.439999999999998 111.128 175.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp 64.14 -164.4 0.25 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.867 1.267 . . . . 73.120000000000005 112.508 -179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 72.64 -59.57 0.56 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.617 1.167 . . . . 74.129999999999995 109.026 -160.473 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 51.64 -175.85 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 126.922 2.089 . . . . 73.150000000000006 115.124 162.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 67.97 151.34 0.08 Allowed 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.097 0.959 . . . . 73.409999999999997 112.325 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 75.54 -57.53 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.862 1.665 . . . . 73.420000000000002 112.44 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.09 72.55 0.56 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 122.839 0.256 . . . . 62.520000000000003 112.826 176.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -88.28 135.45 33.44 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.981 0.913 . . . . 74.239999999999995 111.282 -173.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 19.5 ptp -155.78 137.0 13.83 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 124.28 1.032 . . . . 74.420000000000002 109.819 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.8 91.12 5.29 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 108.96 -0.756 . . . . 70.150000000000006 108.96 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 . . . . . 0 CA--C 1.561 1.391 0 C-N-CA 123.184 0.594 . . . . 75.239999999999995 110.118 177.269 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.357 0.122 . . . . 74.329999999999998 110.81 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -150.87 134.99 16.8 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.183 0.593 . . . . 74.200000000000003 110.167 -176.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -67.94 125.48 26.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.159 0.583 . . . . 75.019999999999996 111.089 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.2 m 67.78 106.74 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 124.882 1.273 . . . . 71.549999999999997 113.349 174.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -119.36 115.44 24.13 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.559 0.744 . . . . 74.329999999999998 109.75 166.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -83.51 92.84 7.69 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.274 0.559 . . . . 74.430000000000007 110.039 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -149.74 -47.94 0.02 OUTLIER Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.439 -0.801 . . . . 72.540000000000006 111.941 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? 60.84 81.06 0.2 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.848 1.259 . . . . 74.329999999999998 111.114 174.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.13 22.17 10.77 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.462 0.705 . . . . 73.329999999999998 111.366 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -80.01 -25.95 40.04 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.631 0.773 . . . . 74.340000000000003 110.746 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 59.04 -94.51 0.05 OUTLIER 'General case' 0 CA--C 1.565 1.529 0 C-N-CA 124.761 1.224 . . . . 74.310000000000002 112.715 176.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 174.62 166.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.78 1.232 . . . . 62.329999999999998 108.92 -176.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? 62.76 2.8 1.02 Allowed 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.863 1.06 . . . . 73.329999999999998 113.863 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.9 p -75.93 110.2 10.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.958 0.503 . . . . 75.420000000000002 110.775 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.5 p -83.42 41.55 0.78 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.974 0.91 . . . . 74.25 110.892 175.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . 0.44 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 -129.98 128.58 42.35 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.368 1.067 . . . . 74.439999999999998 109.699 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 72.420000000000002 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.420000000000002 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.209999999999994 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . 0.44 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.229999999999997 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 72.319999999999993 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.42 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.140000000000001 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.552 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.439999999999998 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.623 HD22 HD23 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 74.409999999999997 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.552 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.409999999999997 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.409999999999997 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.510000000000005 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 72.030000000000001 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 72.450000000000003 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 73.040000000000006 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 73.049999999999997 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.340000000000003 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.540000000000006 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.448 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 71.140000000000001 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.329999999999998 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.109999999999999 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 64.049999999999997 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 71.230000000000004 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.623 HD23 HD22 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 74.340000000000003 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.439999999999998 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.349999999999994 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 75.230000000000004 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.239999999999995 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 72.5 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.310000000000002 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.239999999999995 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.450000000000003 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.549999999999997 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 64.540000000000006 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.549999999999997 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 75.439999999999998 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 74.349999999999994 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 75.040000000000006 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.439999999999998 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.329999999999998 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 75.140000000000001 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.24 -37.59 80.85 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.340000000000003 111.449 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.649 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 13.1 tmtt? -75.68 -41.62 53.29 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.553 0.741 . . . . 71.140000000000001 110.672 174.486 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 92.3 t90 -57.41 -43.15 83.54 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 124.51 1.124 . . . . 73.129999999999995 112.008 -175.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -71.41 -72.23 0.23 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.893 0.477 . . . . 72.430000000000007 110.591 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -169.97 115.1 0.52 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.766 0.826 . . . . 73.439999999999998 109.747 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.649 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 62.2 ttt180 -102.38 -50.1 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.442 0.697 . . . . 75.420000000000002 111.292 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -76.47 129.13 36.07 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.941 0.4 . . . . 71.239999999999995 111.213 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -128.99 137.82 51.58 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.044 0.938 . . . . 74.230000000000004 110.36 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -146.26 -175.37 4.74 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.671 0.789 . . . . 74.409999999999997 110.683 174.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 110.04 39.09 1.59 Allowed Glycine 0 N--CA 1.478 1.473 0 CA-C-O 121.185 0.325 . . . . 74.430000000000007 112.754 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -99.77 99.88 10.75 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.039 0.935 . . . . 64.310000000000002 109.305 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -147.62 -35.5 0.23 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.144 0.794 . . . . 74.219999999999999 113.144 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 63.57 119.05 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 124.514 1.126 . . . . 63.5 111.392 -174.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 CA--C 1.577 1.999 0 N-CA-C 113.948 1.092 . . . . 74.420000000000002 113.948 -170.463 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 110.539 -0.171 . . . . 63.549999999999997 110.539 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -163.06 103.46 0.99 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.761 0.824 . . . . 75.340000000000003 110.456 175.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.3 mtt -87.98 161.32 17.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.178 0.591 . . . . 73.209999999999994 110.432 171.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.8 m -74.81 148.49 40.25 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.733 0.413 . . . . 64.219999999999999 110.517 175.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -77.52 11.55 1.98 Allowed 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 112.786 0.662 . . . . 64.150000000000006 112.786 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -91.64 8.05 38.64 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.952 0.901 . . . . 75.25 111.265 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.1 117.87 11.09 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 113.628 0.211 . . . . 64.120000000000005 113.628 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.06 -175.29 5.69 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.897 0.879 . . . . 73.420000000000002 111.308 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -83.78 64.07 7.84 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 108.462 -0.94 . . . . 74.010000000000005 108.462 164.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -100.34 18.59 18.51 Favored 'General case' 0 CA--C 1.565 1.523 0 C-N-CA 123.748 0.819 . . . . 71.209999999999994 110.834 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 72.58 129.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.112 1.365 . . . . 73.299999999999997 112.893 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -77.13 162.23 27.61 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.353 0.661 . . . . 62.5 111.617 175.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 83.58 5.32 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.942 0.497 . . . . 74.120000000000005 110.258 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.3 m -94.88 35.95 1.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 122.247 1.023 . . . . 70.329999999999998 109.617 177.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 p -90.76 114.12 26.4 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.997 0.919 . . . . 70.310000000000002 111.212 -174.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 62.54 -169.75 0.18 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.435 1.094 . . . . 75.230000000000004 112.926 172.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.530000000000001 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 72.239999999999995 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 72.420000000000002 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.120000000000005 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.329999999999998 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 73.420000000000002 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.519999999999996 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.040000000000006 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.010000000000005 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.42 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.540000000000006 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.444 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.209999999999994 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.4 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.340000000000003 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.219999999999999 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.444 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 73.349999999999994 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.329999999999998 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.430000000000007 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 75.439999999999998 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.530000000000001 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.239999999999995 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.409999999999997 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 73.420000000000002 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.140000000000001 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.019999999999996 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 74.349999999999994 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.510000000000005 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 HD22 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 64.109999999999999 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 71.400000000000006 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 75.319999999999993 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 74.239999999999995 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.340000000000003 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 74.420000000000002 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 73.140000000000001 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.349999999999994 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 74.230000000000004 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.446 ' O ' HG22 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.310000000000002 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.409999999999997 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 72.230000000000004 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 72.219999999999999 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 64.319999999999993 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 71.319999999999993 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 74.0 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 73.209999999999994 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 73.230000000000004 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.4 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.349999999999994 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.310000000000002 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.43 67.66 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 75.310000000000002 111.578 173.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.52 -51.14 68.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.605 0.762 . . . . 71.120000000000005 110.261 171.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -62.88 -35.82 81.26 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.96 0.904 . . . . 75.510000000000005 110.443 176.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -95.29 51.94 1.37 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.417 1.087 . . . . 75.239999999999995 111.551 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt 71.51 117.61 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 124.037 0.935 . . . . 74.150000000000006 113.225 167.727 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.33 -68.76 0.36 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.775 0.83 . . . . 75.200000000000003 112.016 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.37 116.01 19.35 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.169 0.588 . . . . 74.450000000000003 109.818 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -77.49 11.94 1.8 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.144 0.794 . . . . 74.25 113.144 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -71.71 141.9 49.82 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.399 0.68 . . . . 75.299999999999997 111.438 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 134.1 -96.22 0.28 Allowed Glycine 0 C--N 1.343 0.956 0 N-CA-C 110.813 -0.915 . . . . 53.140000000000001 110.813 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -63.18 -39.64 95.22 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.03 0.532 . . . . 73.310000000000002 110.266 172.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 ttt -91.86 124.98 36.39 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.469 0.707 . . . . 74.299999999999997 110.158 170.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.6 91.73 3.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.953 -0.758 . . . . 75.409999999999997 108.953 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.571 1.78 0 C-N-CA 123.279 0.631 . . . . 61.450000000000003 111.758 -175.757 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 111.549 0.203 . . . . 74.340000000000003 111.549 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.36 88.09 1.55 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.12 0.568 . . . . 75.109999999999999 110.889 -176.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtm -92.54 114.75 27.38 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.853 0.861 . . . . 74.329999999999998 110.076 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -66.43 -60.77 2.44 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.859 0.864 . . . . 73.25 112.281 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -90.3 97.27 11.09 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.913 0.485 . . . . 72.450000000000003 109.696 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -133.4 -19.56 2.15 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.806 0.842 . . . . 75.230000000000004 111.619 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.7 79.7 1.87 Allowed Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.185 0.421 . . . . 73.150000000000006 112.837 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -86.15 162.27 18.45 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.591 0.756 . . . . 73.049999999999997 111.4 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.82 89.95 1.51 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.181 0.592 . . . . 74.340000000000003 110.609 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -141.95 106.14 4.78 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.001 0.92 . . . . 75.340000000000003 110.621 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HB3' ' HG3' ' A' ' 13' ' ' ARG . 4.8 mpt_? -81.39 -45.89 15.44 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.941 0.496 . . . . 75.5 110.213 172.264 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.21 36.08 25.48 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.098 0.959 . . . . 63.530000000000001 112.419 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.432 ' HG3' ' HB3' ' A' ' 11' ' ' ARG . 69.6 mtp180 -66.49 -23.24 66.22 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.697 0.799 . . . . 73.540000000000006 111.544 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 27.1 m 69.92 89.9 0.1 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.078 1.351 . . . . 72.109999999999999 111.734 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.8 p -82.47 -35.55 27.35 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.908 0.883 . . . . 73.519999999999996 111.092 175.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -71.52 119.43 15.66 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.294 0.638 . . . . 73.340000000000003 109.941 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.420000000000002 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.425 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 70.010000000000005 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.319999999999993 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.030000000000001 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.329999999999998 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.520000000000003 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 64.200000000000003 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 75.5 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.476 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 74.120000000000005 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.299999999999997 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 61.549999999999997 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 73.109999999999999 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.476 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.439999999999998 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 74.430000000000007 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.020000000000003 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 75.209999999999994 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.420000000000002 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.140000000000001 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.340000000000003 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.486 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 73.200000000000003 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.099999999999994 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 73.310000000000002 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.439999999999998 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.129999999999995 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 74.409999999999997 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.239999999999995 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 71.319999999999993 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 74.030000000000001 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.530000000000001 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.239999999999995 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 74.140000000000001 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 74.349999999999994 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 75.420000000000002 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.049999999999997 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.209999999999994 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 71.340000000000003 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.049999999999997 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 71.319999999999993 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 70.310000000000002 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 75.439999999999998 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.430000000000007 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 74.319999999999993 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.310000000000002 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 72.400000000000006 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.663 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 74.299999999999997 112.667 177.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.26 -53.61 55.6 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 74.409999999999997 111.154 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -73.45 -31.25 63.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.604 -0.726 . . . . 72.409999999999997 111.224 177.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.663 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.9 t90 -64.87 -29.97 70.95 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 111.618 175.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -76.22 -11.73 59.97 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 112.951 0.722 . . . . 74.329999999999998 112.951 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt 76.18 -54.64 0.6 Allowed 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.33 1.052 . . . . 73.310000000000002 113.69 169.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -82.25 48.88 1.32 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.55 0.74 . . . . 72.450000000000003 112.269 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -79.31 80.43 5.67 Favored 'General case' 0 CA--C 1.56 1.333 0 O-C-N 121.817 -0.552 . . . . 75.420000000000002 109.695 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 178.52 -55.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 126.353 1.861 . . . . 74.439999999999998 108.862 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 68.58 -64.05 0.32 Allowed 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.449 1.499 . . . . 72.329999999999998 113.83 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.29 153.99 9.1 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.012 1.165 . . . . 71.400000000000006 116.012 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.09 172.49 11.61 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.412 1.085 . . . . 74.420000000000002 112.658 -172.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 mtt -66.03 93.94 0.22 Allowed 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 123.467 0.707 . . . . 74.129999999999995 110.845 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 111.08 10.98 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.646 0.378 . . . . 74.310000000000002 110.973 178.338 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 123.4 0.68 . . . . 74.150000000000006 111.95 -176.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.495 1.819 0 N-CA-C 110.391 -0.225 . . . . 55.149999999999999 110.391 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -58.33 135.83 57.26 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.412 0.685 . . . . 71.209999999999994 111.186 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.5 mtt 66.42 175.95 0.23 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.781 1.232 . . . . 71.340000000000003 111.791 -171.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 t 58.74 86.74 0.08 Allowed 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.41 1.084 . . . . 72.400000000000006 112.176 -176.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -85.29 170.54 12.7 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.783 0.66 . . . . 74.409999999999997 112.783 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -66.9 102.86 1.02 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.529 0.731 . . . . 74.200000000000003 111.066 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 154.37 25.47 Favored Glycine 0 N--CA 1.47 0.935 0 CA-C-N 116.081 -0.509 . . . . 75.219999999999999 112.617 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt 63.06 -178.91 0.15 Allowed 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.127 0.971 . . . . 75.120000000000005 112.341 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -96.34 -83.14 0.38 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.734 0.414 . . . . 74.439999999999998 109.962 178.262 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 64.15 164.31 0.13 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.573 1.149 . . . . 63.329999999999998 113.229 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtp85 61.87 31.31 18.28 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 123.927 0.891 . . . . 72.530000000000001 113.289 170.021 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -118.17 165.22 14.06 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.541 0.736 . . . . 75.310000000000002 111.862 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 66.47 107.63 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.923 1.289 . . . . 73.549999999999997 112.414 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.7 p -75.22 107.11 7.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.157 0.583 . . . . 74.120000000000005 110.436 175.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.2 m -113.71 -75.4 0.6 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.17 0.588 . . . . 65.040000000000006 110.394 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -117.64 130.82 56.61 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.873 0.469 . . . . 71.019999999999996 110.26 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.140000000000001 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.209999999999994 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.340000000000003 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 64.030000000000001 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.530000000000001 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 74.019999999999996 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.329999999999998 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.508 HD22 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.409999999999997 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.523 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.209999999999994 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.424 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 72.219999999999999 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 74.230000000000004 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.409999999999997 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.109999999999999 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.430000000000007 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 71.299999999999997 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 74.200000000000003 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.430000000000007 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.120000000000005 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.415 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 72.430000000000007 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 72.549999999999997 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 70.030000000000001 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 71.430000000000007 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.5 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 74.030000000000001 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.508 HD21 HD22 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 70.450000000000003 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 74.420000000000002 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 62.420000000000002 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.482 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 74.340000000000003 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.150000000000006 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.540000000000006 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 73.409999999999997 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.040000000000006 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.401 ' O ' HG21 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 65.409999999999997 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.120000000000005 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.401 HG21 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.530000000000001 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.450000000000003 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.239999999999995 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.219999999999999 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.219999999999999 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.319999999999993 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 74.109999999999999 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -57.6 9.39 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.530000000000001 110.461 171.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -53.59 -31.81 48.46 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 124.718 1.207 . . . . 75.239999999999995 113.07 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -80.73 -37.44 30.53 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.822 1.249 . . . . 75.120000000000005 111.753 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -84.04 -64.47 1.16 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.056 0.943 . . . . 75.140000000000001 111.23 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -148.27 124.94 11.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.511 1.124 . . . . 73.099999999999994 109.126 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -55.99 100.54 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.263 0.352 . . . . 73.209999999999994 110.3 178.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.63 134.33 56.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.241 1.016 . . . . 71.439999999999998 111.46 -172.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -135.58 102.52 5.14 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.271 0.628 . . . . 74.400000000000006 111.228 -175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -96.5 161.3 13.97 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 122.802 0.441 . . . . 72.439999999999998 110.392 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.14 -78.66 0.31 Allowed Glycine 0 N--CA 1.47 0.959 0 CA-C-N 116.376 -0.375 . . . . 74.019999999999996 112.267 -177.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.76 145.16 45.29 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.556 0.342 . . . . 75.109999999999999 110.439 173.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 tpt 60.33 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.907 1.283 . . . . 74.25 112.073 -170.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -108.93 118.57 37.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.487 0.715 . . . . 73.340000000000003 109.825 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 . . . . . 0 CA--C 1.57 1.737 0 C-N-CA 123.528 0.731 . . . . 74.439999999999998 112.151 179.971 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 120.412 0.148 . . . . 73.310000000000002 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -137.93 102.53 4.73 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.237 0.615 . . . . 74.129999999999995 109.346 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 ptm -145.42 175.57 10.23 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.965 0.506 . . . . 74.219999999999999 111.808 -175.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.2 m -72.23 103.19 3.28 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.078 0.551 . . . . 74.519999999999996 110.423 173.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -84.18 54.81 3.08 Favored 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 124.02 0.928 . . . . 74.340000000000003 110.406 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -139.73 -31.22 0.68 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.571 1.148 . . . . 73.209999999999994 110.483 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.51 33.27 2.07 Favored Glycine 0 C--N 1.359 1.811 0 N-CA-C 115.254 0.862 . . . . 74.209999999999994 115.254 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -110.1 -37.68 5.51 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.72 0.808 . . . . 73.329999999999998 110.413 174.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 58.93 78.34 0.26 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.252 1.021 . . . . 75.430000000000007 110.878 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.4 mtm-85 -85.15 170.09 13.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.414 -0.812 . . . . 74.310000000000002 111.218 -176.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HB3' ' HD2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -53.42 56.6 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 122.802 0.441 . . . . 73.540000000000006 111.165 176.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 56.18 17.89 2.98 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 114.307 1.225 . . . . 65.349999999999994 114.307 173.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 0.476 ' HD2' ' HB3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -84.83 -4.31 59.03 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.488 0.715 . . . . 74.340000000000003 112.062 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.5 m 79.56 119.27 0.05 Allowed 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.497 1.519 . . . . 75.510000000000005 112.406 -178.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.3 m -147.48 -56.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.901 1.28 . . . . 74.510000000000005 108.595 171.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -127.66 130.14 48.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.257 1.023 . . . . 73.120000000000005 108.955 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.310000000000002 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 62.240000000000002 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.049999999999997 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.420000000000002 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 74.510000000000005 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.109999999999999 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.420000000000002 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.498 HD22 HD23 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.150000000000006 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.455 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.230000000000004 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 73.120000000000005 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 64.299999999999997 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 65.299999999999997 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.455 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 79.3 mm-40 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.120000000000005 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.140000000000001 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.140000000000001 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.319999999999993 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 75.319999999999993 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 74.319999999999993 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.209999999999994 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 74.420000000000002 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.43 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 55.329999999999998 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.049999999999997 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 72.340000000000003 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.349999999999994 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.498 HD23 HD22 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 73.5 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.349999999999994 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 74.109999999999999 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 74.099999999999994 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 75.25 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 73.019999999999996 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 74.239999999999995 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.559 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 72.430000000000007 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.030000000000001 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 73.219999999999999 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.559 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 73.549999999999997 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 75.140000000000001 110.018 171.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.530000000000001 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.219999999999999 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 75.310000000000002 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.510000000000005 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.109999999999999 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 74.430000000000007 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.491 HH21 ' HG3' ' A' ' 63' ' ' LYS . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 110.995 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.563 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 72.340000000000003 111.527 172.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' HH21 ' A' ' 65' ' ' ARG . . . -64.54 -31.82 73.21 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 61.530000000000001 111.528 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.491 ' HG3' HH21 ' A' ' 60' ' ' ARG . 33.0 mmtm -83.3 -42.46 17.11 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.603 0.761 . . . . 65.040000000000006 111.835 171.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.563 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 68.7 t90 -56.89 -36.01 69.63 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.695 1.198 . . . . 75.230000000000004 112.383 -175.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.436 HH21 ' HA ' ' A' ' 62' ' ' ALA . 67.6 mtm180 -66.16 111.1 3.25 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 123.126 0.57 . . . . 74.430000000000007 111.062 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -70.98 131.78 44.19 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.665 0.786 . . . . 72.120000000000005 111.924 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ptt85 -142.9 108.92 5.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.15 0.58 . . . . 75.099999999999994 110.717 174.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 64.04 5.68 2.52 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.862 1.265 . . . . 74.409999999999997 113.946 173.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 56.43 31.13 18.25 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.294 1.038 . . . . 73.430000000000007 111.3 -170.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 61.27 34.97 18.38 Favored 'General case' 0 CA--C 1.565 1.544 0 C-N-CA 124.979 1.312 . . . . 64.209999999999994 112.076 -175.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.51 -140.55 15.11 Favored Glycine 0 C--N 1.353 1.484 0 CA-C-N 115.836 -0.62 . . . . 64.209999999999994 113.4 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 61.08 55.0 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.719 1.208 . . . . 64.0 111.616 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.4 mmt -81.89 99.23 8.93 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.217 -0.901 . . . . 74.540000000000006 111.43 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -118.64 -74.19 0.62 Allowed 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.683 0.793 . . . . 64.329999999999998 111.011 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 . . . . . 0 CA--C 1.571 1.751 0 C-N-CA 122.935 0.494 . . . . 75.099999999999994 111.282 176.156 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 110.595 -0.15 . . . . 74.340000000000003 110.595 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -83.24 49.26 1.52 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 113.267 0.84 . . . . 74.420000000000002 113.267 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -114.47 -47.85 2.9 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.877 0.871 . . . . 75.549999999999997 110.231 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.8 m 58.92 32.53 22.34 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.392 1.077 . . . . 73.439999999999998 111.837 -175.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.58 73.88 0.35 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.456 1.502 . . . . 75.040000000000006 111.974 -172.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt 55.52 -82.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.217 1.407 . . . . 75.420000000000002 114.028 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.98 -139.9 17.34 Favored Glycine 0 C--N 1.35 1.345 0 N-CA-C 111.293 -0.723 . . . . 53.240000000000002 111.293 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt 59.2 25.0 13.47 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 124.593 1.157 . . . . 75.239999999999995 112.548 174.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -72.02 83.6 0.97 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.816 -0.809 . . . . 74.420000000000002 108.816 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -85.72 42.52 0.97 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.262 0.625 . . . . 73.25 112.456 -171.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -73.52 89.6 1.7 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-O 121.907 0.86 . . . . 75.200000000000003 109.824 171.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -154.09 168.12 27.53 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.927 1.291 . . . . 73.140000000000001 109.258 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 22.7 tpt180 -83.1 153.51 24.82 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.302 -0.629 . . . . 71.319999999999993 109.302 173.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 m -63.28 95.92 0.1 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.951 0.405 . . . . 74.239999999999995 110.44 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.0 p -94.85 -40.18 9.86 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.03 0.932 . . . . 74.150000000000006 110.935 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -140.18 157.72 45.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.118 0.967 . . . . 75.040000000000006 110.329 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 74.219999999999999 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.219999999999999 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 74.450000000000003 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.409999999999997 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 53.420000000000002 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.129999999999995 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 63.240000000000002 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 74.209999999999994 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.419 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 74.239999999999995 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.683 ' HB2' ' HZ1' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 75.209999999999994 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.430000000000007 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.109999999999999 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.120000000000005 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 74.319999999999993 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.319999999999993 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . 0.419 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.319999999999993 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.420000000000002 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.439999999999998 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 72.430000000000007 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.239999999999995 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.319999999999993 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.66 HH11 HG11 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.299999999999997 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.519999999999996 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 73.109999999999999 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 75.319999999999993 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.010000000000005 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.140000000000001 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 71.129999999999995 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 73.019999999999996 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.340000000000003 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 75.109999999999999 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.129999999999995 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 64.219999999999999 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 53.149999999999999 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.510000000000005 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.66 HG11 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.209999999999994 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 75.420000000000002 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 74.150000000000006 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 74.209999999999994 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.340000000000003 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.454 ' NE2' HH21 ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 72.439999999999998 111.15 175.099 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 75.25 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.349999999999994 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . 0.492 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 75.200000000000003 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.49 -45.29 76.29 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.329999999999998 109.993 167.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -67.91 -31.56 71.42 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 124.732 1.213 . . . . 74.129999999999995 111.747 175.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . 0.492 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.0 t90 -64.7 -21.29 66.71 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.991 1.316 . . . . 72.150000000000006 112.289 177.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.441 ' HG3' ' O ' ' A' ' 61' ' ' ARG . 80.0 mtt180 -80.8 -23.69 39.07 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.278 0.631 . . . . 73.109999999999999 112.604 177.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.2 mptt 51.53 98.67 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.866 1.267 . . . . 74.040000000000006 113.041 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -82.8 148.62 27.68 Favored 'General case' 0 CA--C 1.559 1.299 0 O-C-N 122.019 -0.425 . . . . 74.409999999999997 110.021 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 69.05 44.65 0.99 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.894 1.278 . . . . 73.299999999999997 111.855 -174.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -62.19 -48.58 79.39 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.617 0.767 . . . . 74.219999999999999 110.89 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -82.24 164.56 21.1 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.252 -0.885 . . . . 75.25 111.049 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.79 169.55 45.99 Favored Glycine 0 CA--C 1.534 1.259 0 CA-C-N 116.272 -0.422 . . . . 74.040000000000006 113.917 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -83.6 160.37 21.42 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 74.540000000000006 110.728 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 80.7 mtp -70.56 158.83 35.44 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.841 0.353 . . . . 73.099999999999994 111.012 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -71.75 134.6 46.32 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.102 0.561 . . . . 70.040000000000006 112.0 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 . . . . . 0 C--O 1.258 1.512 0 C-N-CA 123.46 0.704 . . . . 72.430000000000007 110.163 178.661 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 120.607 0.242 . . . . 61.530000000000001 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -132.15 135.18 46.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.806 0.842 . . . . 75.519999999999996 110.602 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.3 mtm -96.6 160.97 14.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.559 0.743 . . . . 74.140000000000001 110.612 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.6 p -76.35 77.03 3.11 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 112.571 0.582 . . . . 74.310000000000002 112.571 -174.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.6 t30 61.67 172.08 0.12 Allowed 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.639 1.175 . . . . 75.030000000000001 112.685 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -106.64 95.07 5.48 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.858 0.837 . . . . 73.530000000000001 110.377 172.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 90.47 1.31 Allowed Glycine 0 CA--C 1.533 1.207 0 CA-C-N 115.56 -0.745 . . . . 75.430000000000007 113.377 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -97.4 16.21 20.79 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.142 0.577 . . . . 75.150000000000006 111.55 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -64.0 111.12 2.37 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.824 0.85 . . . . 72.450000000000003 112.197 -174.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -88.66 152.28 21.92 Favored 'General case' 0 CA--C 1.561 1.404 0 C-N-CA 123.592 0.757 . . . . 75.230000000000004 111.596 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? 63.42 101.64 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.165 1.386 . . . . 73.420000000000002 113.349 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -98.93 13.05 34.0 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.693 0.797 . . . . 70.510000000000005 111.751 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -67.13 99.35 0.66 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.223 0.609 . . . . 73.099999999999994 112.305 -174.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.5 t -138.08 26.91 2.67 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.947 0.899 . . . . 73.329999999999998 110.247 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.0 p -76.17 -53.17 8.67 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.461 0.704 . . . . 71.219999999999999 111.587 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 63.26 174.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.898 1.279 . . . . 70.329999999999998 112.903 -176.618 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.230000000000004 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.519999999999996 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.219999999999999 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.109999999999999 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 75.519999999999996 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.310000000000002 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.040000000000006 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.310000000000002 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.510000000000005 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.510000000000005 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 71.239999999999995 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.340000000000003 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 72.25 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.239999999999995 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.310000000000002 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 72.030000000000001 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.200000000000003 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.200000000000003 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 74.420000000000002 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.120000000000005 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.530000000000001 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 71.129999999999995 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ARG . . . . . 0.436 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.299999999999997 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.310000000000002 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 74.25 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.340000000000003 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.340000000000003 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.340000000000003 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.299999999999997 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 73.319999999999993 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 73.209999999999994 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 75.219999999999999 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 72.439999999999998 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.140000000000001 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 72.450000000000003 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.319999999999993 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 74.099999999999994 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.120000000000005 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 74.140000000000001 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.329999999999998 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.319999999999993 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.530000000000001 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 74.430000000000007 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 74.239999999999995 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.39 -27.65 62.5 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.530000000000001 111.605 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.73 ' HA ' ' HZ1' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -82.28 -27.01 32.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.821 0.449 . . . . 74.530000000000001 110.959 171.912 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -77.23 -39.68 47.6 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.493 0.717 . . . . 74.219999999999999 111.477 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.465 ' NH2' ' HB2' ' A' ' 68' ' ' GLU . 34.3 ttt180 -125.22 142.52 51.45 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.002 0.521 . . . . 74.349999999999994 111.482 -176.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -137.75 -37.8 0.59 Allowed 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.923 0.712 . . . . 75.420000000000002 112.923 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -58.93 -73.24 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 113.755 1.02 . . . . 74.109999999999999 113.755 -170.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.465 ' HB2' ' NH2' ' A' ' 65' ' ' ARG . 3.6 mp0 -99.98 161.0 13.88 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 118.465 0.575 . . . . 64.209999999999994 111.238 175.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -89.78 -34.49 16.15 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.844 0.457 . . . . 72.329999999999998 111.005 173.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.2 t80 55.15 92.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.948 1.299 . . . . 75.319999999999993 112.338 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -165.37 -175.69 36.22 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 116.43 -0.35 . . . . 73.239999999999995 113.398 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -47.59 49.28 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.266 0.626 . . . . 74.239999999999995 110.139 177.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 15.7 tpt -149.22 -78.26 0.14 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.791 0.436 . . . . 75.230000000000004 110.277 174.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -172.82 137.01 0.73 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.871 0.868 . . . . 74.510000000000005 109.969 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.489 1.484 0 C-N-CA 123.252 0.621 . . . . 75.349999999999994 111.643 177.521 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.555 1.154 0 CA-C-O 120.805 0.336 . . . . 73.239999999999995 111.248 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 51.210000000000001 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 62.409999999999997 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.340000000000003 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 72.140000000000001 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 74.540000000000006 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.140000000000001 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.010000000000005 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.613 HD23 HD21 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.319999999999993 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 61.439999999999998 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.530000000000001 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.140000000000001 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 74.239999999999995 111.204 172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 65.420000000000002 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.140000000000001 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 71.319999999999993 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 60.130000000000003 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.420000000000002 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.530000000000001 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 64.049999999999997 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 73.340000000000003 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 73.340000000000003 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 65.430000000000007 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.150000000000006 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.613 HD21 HD23 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 73.209999999999994 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 52.43 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.109999999999999 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.310000000000002 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 62.409999999999997 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.109999999999999 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.439999999999998 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 52.310000000000002 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.310000000000002 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.310000000000002 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.519999999999996 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 55.340000000000003 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 54.229999999999997 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 65.010000000000005 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.340000000000003 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.209999999999994 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.230000000000004 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.519999999999996 110.29 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 71.409999999999997 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 72.349999999999994 111.801 176.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 63.310000000000002 111.167 177.165 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.399 0.618 . . . . 43.329999999999998 111.983 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 71.430000000000007 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.099999999999994 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.150000000000006 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 64.040000000000006 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.219999999999999 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.54 HD23 HD21 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.129999999999995 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.340000000000003 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 72.530000000000001 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 72.530000000000001 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 44.399999999999999 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 72.420000000000002 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 72.319999999999993 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 63.119999999999997 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.450000000000003 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 72.129999999999995 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.109999999999999 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.445 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.209999999999994 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 53.119999999999997 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 73.129999999999995 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.409999999999997 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.409999999999997 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.340000000000003 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.54 HD21 HD23 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 61.329999999999998 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.530000000000001 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 62.210000000000001 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 72.519999999999996 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.239999999999995 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.030000000000001 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.340000000000003 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.209999999999994 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.210000000000001 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 71.420000000000002 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.109999999999999 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.140000000000001 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.239999999999995 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.140000000000001 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 71.209999999999994 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 61.509999999999998 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.219999999999999 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 73.319999999999993 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 51.140000000000001 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.239999999999995 110.801 175.407 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.005 0.431 . . . . 64.030000000000001 111.775 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 45.409999999999997 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 63.420000000000002 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.340000000000003 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 63.329999999999998 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.310000000000002 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.409999999999997 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 71.310000000000002 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.209999999999994 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.010000000000005 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.140000000000001 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.239999999999995 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.340000000000003 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 12.9 mm100 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.329999999999998 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.209999999999994 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.239999999999995 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.219999999999999 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.530000000000001 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.140000000000001 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.299999999999997 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.420000000000002 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 71.230000000000004 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 41.439999999999998 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 72.120000000000005 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 72.219999999999999 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 64.230000000000004 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 52.219999999999999 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.420000000000002 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.519999999999996 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 70.439999999999998 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.329999999999998 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.010000000000005 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.099999999999994 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.200000000000003 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.519999999999996 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.099999999999994 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 72.349999999999994 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.230000000000004 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 73.239999999999995 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.435 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 63.439999999999998 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.409 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.340000000000003 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 73.409999999999997 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 60.329999999999998 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 70.5 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.329999999999998 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 51.539999999999999 111.721 -178.165 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.079 0.466 . . . . 74.510000000000005 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.519999999999996 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 51.420000000000002 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.150000000000006 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.439999999999998 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.340000000000003 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.319999999999993 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 64.120000000000005 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.674 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.439999999999998 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.510000000000005 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 62.030000000000001 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 53.030000000000001 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 73.349999999999994 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 55.210000000000001 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 72.349999999999994 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.774 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.430000000000007 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.150000000000006 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.400000000000006 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.219999999999999 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 73.420000000000002 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 71.120000000000005 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 72.510000000000005 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 55.149999999999999 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.319999999999993 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.319999999999993 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.674 HD21 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.030000000000001 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 72.519999999999996 112.628 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 71.319999999999993 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 62.009999999999998 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 44.130000000000003 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.230000000000004 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.310000000000002 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.219999999999999 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 73.400000000000006 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.420000000000002 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.239999999999995 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.430000000000007 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 62.399999999999999 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.230000000000004 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.299999999999997 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 54.229999999999997 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 42.520000000000003 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.329999999999998 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.774 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.019999999999996 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.319999999999993 110.59 172.542 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.01 -0.367 . . . . 64.010000000000005 110.01 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.239999999999995 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.219999999999999 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 55.340000000000003 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.019999999999996 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 62.439999999999998 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.219999999999999 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 73.540000000000006 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.049999999999997 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 51.439999999999998 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 70.209999999999994 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 61.140000000000001 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.409999999999997 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.420000000000002 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 74.340000000000003 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.150000000000006 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 72.510000000000005 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 32.32 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 61.229999999999997 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 65.299999999999997 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.310000000000002 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.200000000000003 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 64.010000000000005 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 71.310000000000002 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 15.5 mm100 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 64.049999999999997 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.420000000000002 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.310000000000002 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.420000000000002 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.530000000000001 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.340000000000003 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.409999999999997 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.129999999999995 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 70.030000000000001 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.209999999999994 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 65.200000000000003 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 65.430000000000007 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.349999999999994 110.663 172.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 40.340000000000003 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.129999999999995 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.109999999999999 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 72.319999999999993 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.239999999999995 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.510000000000005 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 73.25 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.009999999999998 111.794 -177.915 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.364 0.135 . . . . 74.340000000000003 111.364 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.120000000000005 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.120000000000005 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.540000000000006 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 64.439999999999998 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 71.540000000000006 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.409999999999997 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.458 HD23 HD21 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 62.299999999999997 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.209999999999994 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 61.329999999999998 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.400000000000006 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.120000000000005 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.239999999999995 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 64.420000000000002 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 61.439999999999998 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 71.109999999999999 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.200000000000003 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.030000000000001 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 63.240000000000002 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 62.539999999999999 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 53.130000000000003 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.209999999999994 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.430000000000007 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 65.340000000000003 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD21 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 72.340000000000003 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.150000000000006 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 53.450000000000003 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.310000000000002 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 72.030000000000001 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 65.510000000000005 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 54.539999999999999 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 73.120000000000005 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.219999999999999 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 53.009999999999998 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.430000000000007 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 45.25 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 64.540000000000006 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 53.520000000000003 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 72.329999999999998 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.606 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 72.219999999999999 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.150000000000006 110.933 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.430000000000007 110.225 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.099999999999994 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.606 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.310000000000002 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 64.010000000000005 111.134 172.303 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 108.509 -0.923 . . . . 71.409999999999997 108.509 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 54.25 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.310000000000002 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.219999999999999 111.14 -178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 52.450000000000003 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.239999999999995 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 54.549999999999997 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' GLN . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.329999999999998 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 71.239999999999995 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 64.120000000000005 110.926 173.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 65.420000000000002 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 65.329999999999998 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.230000000000004 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 63.539999999999999 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.129999999999995 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 64.540000000000006 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.099999999999994 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.219999999999999 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.120000000000005 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 71.430000000000007 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 61.130000000000003 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.749 HH11 HG12 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 72.310000000000002 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.420000000000002 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 65.319999999999993 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 63.140000000000001 112.264 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 53.43 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.450000000000003 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.329999999999998 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.430000000000007 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 74.140000000000001 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.239999999999995 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 70.109999999999999 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.441 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 72.219999999999999 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 52.219999999999999 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 74.010000000000005 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.749 HG12 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 64.310000000000002 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 64.129999999999995 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.530000000000001 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.329999999999998 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 71.310000000000002 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.019999999999996 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 72.219999999999999 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 73.010000000000005 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.400000000000006 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.539999999999999 111.317 173.491 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 120.537 0.208 . . . . 75.340000000000003 110.913 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.409999999999997 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.340000000000003 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.510000000000005 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 73.140000000000001 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 64.109999999999999 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.019999999999996 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 71.319999999999993 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 72.409999999999997 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 61.450000000000003 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.219999999999999 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.230000000000004 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 50.340000000000003 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.409999999999997 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.340000000000003 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 53.340000000000003 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 52.149999999999999 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.329999999999998 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.510000000000005 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.549999999999997 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 63.140000000000001 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.129999999999995 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.400000000000006 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 64.530000000000001 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 43.399999999999999 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 74.450000000000003 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.489 HD21 HD23 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.510000000000005 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 65.129999999999995 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.229999999999997 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 72.129999999999995 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.450000000000003 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.420000000000002 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 60.149999999999999 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 72.329999999999998 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 73.349999999999994 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.200000000000003 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.209999999999994 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.475 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 64.310000000000002 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 71.420000000000002 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 71.319999999999993 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.400000000000006 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.310000000000002 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.310000000000002 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.319999999999993 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.400000000000006 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 72.540000000000006 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 65.010000000000005 110.696 175.619 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.289 0.566 . . . . 70.310000000000002 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 53.25 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 63.420000000000002 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.439999999999998 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.530000000000001 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.430000000000007 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.340000000000003 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.420000000000002 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 65.010000000000005 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 61.439999999999998 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.150000000000006 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 71.019999999999996 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 72.049999999999997 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 62.420000000000002 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 64.540000000000006 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 71.340000000000003 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.464 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.430000000000007 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.329999999999998 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.409999999999997 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 71.530000000000001 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.230000000000004 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 72.510000000000005 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 71.219999999999999 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.019999999999996 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 44.409999999999997 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.010000000000005 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.349999999999994 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 72.439999999999998 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.430000000000007 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.450000000000003 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 74.109999999999999 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 70.219999999999999 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 34.530000000000001 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.420000000000002 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 62.299999999999997 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.340000000000003 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 60.100000000000001 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.450000000000003 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 74.319999999999993 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 54.229999999999997 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.530000000000001 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.430000000000007 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 63.539999999999999 111.34 176.107 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 112.899 0.703 . . . . 60.43 112.899 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 63.530000000000001 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 44.219999999999999 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.409999999999997 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.510000000000005 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 71.540000000000006 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.150000000000006 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.099999999999994 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.539 HD23 HD21 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 70.439999999999998 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.150000000000006 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 62.329999999999998 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.349999999999994 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.439999999999998 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.209999999999994 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 64.200000000000003 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.420000000000002 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.409999999999997 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.409999999999997 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 64.450000000000003 113.739 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.019999999999996 112.512 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.540000000000006 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 71.200000000000003 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 51.219999999999999 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.418 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 63.340000000000003 111.231 176.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.409999999999997 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 65.420000000000002 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD21 HD23 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.140000000000001 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 60.119999999999997 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 71.239999999999995 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 60.420000000000002 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.624 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 41.43 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 74.329999999999998 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.409999999999997 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.230000000000004 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.409999999999997 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HD3' HD22 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 54.409999999999997 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 63.539999999999999 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.430000000000007 112.468 177.264 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.140000000000001 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 72.299999999999997 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 71.200000000000003 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.230000000000004 109.951 177.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.420000000000002 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 62.210000000000001 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.409999999999997 111.875 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 32.439999999999998 110.559 172.064 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 111.529 0.196 . . . . 75.430000000000007 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 62.140000000000001 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 53.530000000000001 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 71.299999999999997 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.643 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 70.040000000000006 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.329999999999998 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.140000000000001 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 63.119999999999997 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 63.420000000000002 111.128 176.44 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.120000000000005 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 63.340000000000003 111.816 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.329999999999998 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 73.549999999999997 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.349999999999994 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.019999999999996 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.030000000000001 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 62.5 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 72.510000000000005 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.129999999999995 112.924 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.519999999999996 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 62.5 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.310000000000002 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.129999999999995 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 73.140000000000001 111.385 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.310000000000002 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 62.43 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 62.350000000000001 110.964 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 63.299999999999997 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 53.539999999999999 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.120000000000005 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.643 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 64.549999999999997 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.340000000000003 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.424 ' HG ' HE21 ' A' ' 20' ' ' GLN . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 71.409999999999997 112.079 -178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 60.229999999999997 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.430000000000007 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.420000000000002 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.420000000000002 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 65.200000000000003 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.420000000000002 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 55.420000000000002 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.120000000000005 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.310000000000002 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.150000000000006 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 63.439999999999998 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.049999999999997 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 74.140000000000001 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 74.400000000000006 111.491 175.58 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 111.238 0.088 . . . . 61.340000000000003 111.238 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 61.130000000000003 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 62.210000000000001 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.109999999999999 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.150000000000006 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 63.240000000000002 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.140000000000001 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 62.409999999999997 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.584 HD23 HD21 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.329999999999998 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 63.43 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 53.140000000000001 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 63.229999999999997 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.109999999999999 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.010000000000005 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.219999999999999 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 71.439999999999998 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.319999999999993 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.689 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.310000000000002 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.319999999999993 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 73.140000000000001 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.109999999999999 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 73.150000000000006 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.510000000000005 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 71.040000000000006 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 71.450000000000003 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.584 HD21 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 61.149999999999999 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 63.210000000000001 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.409999999999997 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 73.099999999999994 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.556 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 63.229999999999997 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.120000000000005 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.140000000000001 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 61.229999999999997 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 72.540000000000006 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.310000000000002 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.658 ' HG2' HD22 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.209999999999994 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.040000000000006 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.540000000000006 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 72.209999999999994 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.030000000000001 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.040000000000006 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.409999999999997 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 61.439999999999998 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.540000000000006 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.689 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.319999999999993 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 54.049999999999997 111.518 177.482 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 112.438 0.533 . . . . 70.25 112.438 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 52.530000000000001 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.230000000000004 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 64.340000000000003 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.519999999999996 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.219999999999999 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.099999999999994 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.485 HD23 HD21 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 64.040000000000006 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 70.510000000000005 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 74.549999999999997 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.515 HG21 HD13 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.420000000000002 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.109999999999999 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 14.4 mm100 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.140000000000001 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 64.439999999999998 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 71.519999999999996 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 73.239999999999995 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 73.340000000000003 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.530000000000001 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.319999999999993 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.239999999999995 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.120000000000005 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.540000000000006 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 72.439999999999998 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.515 HD13 HG21 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 73.439999999999998 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 62.039999999999999 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 71.329999999999998 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.439999999999998 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.040000000000006 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 64.120000000000005 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.150000000000006 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.140000000000001 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.530000000000001 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 62.25 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.329999999999998 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 72.150000000000006 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.400000000000006 112.251 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 71.140000000000001 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TRP . . . . . 0.409 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.239999999999995 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.519999999999996 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 63.130000000000003 111.429 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 63.5 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.099999999999994 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.230000000000004 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 60.25 111.776 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 109.699 -0.482 . . . . 74.439999999999998 109.699 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 70.439999999999998 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.420000000000002 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.209999999999994 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.229999999999997 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 71.129999999999995 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.109999999999999 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.556 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.439999999999998 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.631 HD23 HD21 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 70.299999999999997 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.556 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.209999999999994 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.310000000000002 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.510000000000005 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 64.0 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 55.43 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 65.340000000000003 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 64.319999999999993 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.340000000000003 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.540000000000006 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 70.510000000000005 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.329999999999998 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.109999999999999 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 55.130000000000003 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 62.32 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD21 HD23 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 73.299999999999997 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.439999999999998 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.349999999999994 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 74.329999999999998 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.239999999999995 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 64.409999999999997 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.230000000000004 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.239999999999995 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.450000000000003 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.510000000000005 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 54.100000000000001 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.549999999999997 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 54.119999999999997 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 72.120000000000005 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 73.430000000000007 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.439999999999998 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.329999999999998 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 64.439999999999998 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.340000000000003 111.449 177.376 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 112.926 0.713 . . . . 75.230000000000004 112.926 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.530000000000001 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 63.43 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 65.25 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.120000000000005 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.329999999999998 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 70.439999999999998 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.519999999999996 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.529 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.040000000000006 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.010000000000005 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.540000000000006 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.437 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.209999999999994 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.109999999999999 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.219999999999999 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 72.230000000000004 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.329999999999998 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.099999999999994 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 71.430000000000007 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.530000000000001 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.239999999999995 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.409999999999997 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 72.010000000000005 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.140000000000001 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.019999999999996 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 72.450000000000003 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.510000000000005 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.529 HD21 HD23 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 61.130000000000003 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 70.099999999999994 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 74.310000000000002 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 64.439999999999998 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.210000000000001 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 55.130000000000003 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 62.32 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.349999999999994 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 55.240000000000002 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.467 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.310000000000002 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.409999999999997 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 45.340000000000003 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 64.409999999999997 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 54.340000000000003 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 64.129999999999995 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 71.040000000000006 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 55.030000000000001 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 62.32 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.349999999999994 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.310000000000002 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 65.129999999999995 111.578 173.349 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.941 -0.392 . . . . 63.210000000000001 109.941 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.420000000000002 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 64.219999999999999 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.319999999999993 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.030000000000001 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.329999999999998 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.520000000000003 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 54.25 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 53.210000000000001 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 73.0 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.299999999999997 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 44.219999999999999 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 63.130000000000003 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.439999999999998 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 53.420000000000002 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.020000000000003 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 72.010000000000005 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.420000000000002 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.140000000000001 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.340000000000003 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 65.420000000000002 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.099999999999994 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 61.109999999999999 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.120000000000005 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.129999999999995 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 62.520000000000003 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.239999999999995 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 63.219999999999999 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 65.519999999999996 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.530000000000001 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.239999999999995 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 45.520000000000003 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 64.25 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 53.240000000000002 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.049999999999997 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.209999999999994 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 63.210000000000001 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.049999999999997 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 64.420000000000002 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 41.229999999999997 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 73.129999999999995 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.420000000000002 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 72.329999999999998 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.310000000000002 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 65.150000000000006 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 73.430000000000007 112.667 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 72.030000000000001 111.154 176.115 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 110.26 -0.274 . . . . 54.240000000000002 110.26 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.140000000000001 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.209999999999994 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.340000000000003 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 33.140000000000001 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.530000000000001 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 61.0 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.329999999999998 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.506 HD23 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.400000000000006 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.209999999999994 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 55.130000000000003 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 71.209999999999994 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.409999999999997 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.109999999999999 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.430000000000007 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 53.140000000000001 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 72.150000000000006 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.430000000000007 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.120000000000005 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 71.230000000000004 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 71.25 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 44.009999999999998 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 41.509999999999998 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.140000000000001 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 70.239999999999995 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 54.229999999999997 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 71.150000000000006 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 61.109999999999999 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 73.519999999999996 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.150000000000006 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.540000000000006 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 63.539999999999999 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.040000000000006 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 45.229999999999997 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.120000000000005 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.530000000000001 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.450000000000003 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.239999999999995 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.219999999999999 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.099999999999994 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.109999999999999 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 73.439999999999998 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.530000000000001 110.461 171.208 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.955 -0.757 . . . . 70.409999999999997 108.955 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.310000000000002 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 52.43 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.049999999999997 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.420000000000002 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 72.340000000000003 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.109999999999999 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.420000000000002 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.499 HD23 HD21 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.150000000000006 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.230000000000004 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 70.430000000000007 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 63.32 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 64.230000000000004 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.7 mm100 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.120000000000005 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.140000000000001 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.140000000000001 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.319999999999993 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 74.439999999999998 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 71.530000000000001 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.209999999999994 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 73.549999999999997 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.409999999999997 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 51.130000000000003 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.010000000000005 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 64.329999999999998 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.349999999999994 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.499 HD21 HD23 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 71.099999999999994 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.349999999999994 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 61.439999999999998 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 63.020000000000003 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 70.239999999999995 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 54.039999999999999 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 64.140000000000001 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 52.140000000000001 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.030000000000001 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 42.119999999999997 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.543 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 55.119999999999997 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.435 HG13 HD23 ' A' ' 42' ' ' LEU . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 63.439999999999998 110.018 171.145 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.530000000000001 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.219999999999999 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 72.230000000000004 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.510000000000005 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.109999999999999 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 61.32 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 110.995 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 54.32 111.527 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 45.149999999999999 111.528 172.366 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 110.329 -0.248 . . . . 75.040000000000006 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 73.219999999999999 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.219999999999999 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 73.430000000000007 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.400000000000006 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 40.219999999999999 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.129999999999995 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 53.409999999999997 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 70.019999999999996 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 54.100000000000001 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.424 ' NZ ' ' HB2' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 70.239999999999995 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.430000000000007 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.109999999999999 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.120000000000005 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 73.239999999999995 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.319999999999993 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . 0.421 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.319999999999993 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.420000000000002 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.439999999999998 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 53.009999999999998 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.239999999999995 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.319999999999993 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.697 HH11 HG12 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.299999999999997 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.519999999999996 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 52.229999999999997 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 72.430000000000007 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.010000000000005 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.140000000000001 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 63.43 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 64.239999999999995 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.340000000000003 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 74.209999999999994 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.129999999999995 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 63.299999999999997 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 51.140000000000001 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.510000000000005 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.697 HG12 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.209999999999994 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 70.25 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 73.519999999999996 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 72.239999999999995 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.340000000000003 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 70.0 111.15 175.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 65.310000000000002 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.349999999999994 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . 0.421 ' HD3' ' O ' ' A' ' 32' ' ' HIS . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 74.049999999999997 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.329999999999998 109.993 167.71 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 112.903 0.705 . . . . 70.329999999999998 112.903 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.230000000000004 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.519999999999996 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.219999999999999 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.109999999999999 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 70.319999999999993 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.310000000000002 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.040000000000006 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.310000000000002 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.510000000000005 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.510000000000005 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 64.530000000000001 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.310000000000002 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 63.130000000000003 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.239999999999995 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.230000000000004 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 65.409999999999997 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.200000000000003 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.200000000000003 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASP . . . . . 0.435 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 73.129999999999995 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.120000000000005 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.530000000000001 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 40.210000000000001 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.299999999999997 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.310000000000002 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 73.219999999999999 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.340000000000003 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.130000000000003 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.340000000000003 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.299999999999997 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 53.229999999999997 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 70.209999999999994 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 61.32 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 70.409999999999997 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.140000000000001 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 50.229999999999997 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.319999999999993 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 73.430000000000007 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.120000000000005 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 73.510000000000005 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.329999999999998 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.319999999999993 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.530000000000001 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 64.430000000000007 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 72.150000000000006 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.530000000000001 111.605 173.758 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.189 -0.3 . . . . 74.450000000000003 110.189 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -153.41 88.84 1.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.5 0.72 . . . . 74.129999999999995 109.726 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.5 mtt 56.99 34.91 25.69 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 124.9 1.28 . . . . 72.510000000000005 111.259 -174.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.7 m -86.69 179.45 6.78 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.487 1.115 . . . . 63.020000000000003 112.132 -174.526 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.2 m120 60.58 41.45 15.44 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.469 1.508 . . . . 71.540000000000006 112.807 172.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -84.36 -4.92 59.18 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 115.426 -0.806 . . . . 74.540000000000006 112.099 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.41 98.25 1.12 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.023 -0.431 . . . . 21.52 112.023 173.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -66.37 107.21 1.94 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.683 0.793 . . . . 72.400000000000006 111.743 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -80.65 114.67 19.7 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.244 0.617 . . . . 61.520000000000003 111.594 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HA ' ' HE ' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -86.38 -25.8 25.13 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.599 0.76 . . . . 72.409999999999997 110.827 170.911 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -76.45 97.7 4.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.459 0.703 . . . . 70.540000000000006 111.011 176.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.6 t30 67.41 130.73 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.413 1.485 . . . . 74.549999999999997 113.537 172.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -67.05 -68.04 0.41 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.99 0.916 . . . . 61.210000000000001 110.824 177.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.1 m -109.9 118.38 36.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.448 0.699 . . . . 43.329999999999998 109.387 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.1 m -57.12 -30.3 64.28 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.241 1.016 . . . . 51.520000000000003 111.827 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -106.17 167.24 9.95 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.015 0.926 . . . . 73.239999999999995 111.248 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 51.210000000000001 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 62.409999999999997 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.340000000000003 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 72.140000000000001 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 74.540000000000006 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.140000000000001 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.010000000000005 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.613 HD23 HD21 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.319999999999993 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 61.439999999999998 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.530000000000001 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.140000000000001 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 74.239999999999995 111.204 172.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 65.420000000000002 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.140000000000001 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 71.319999999999993 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 60.130000000000003 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.420000000000002 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.530000000000001 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 64.049999999999997 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 73.340000000000003 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 73.340000000000003 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 65.430000000000007 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.150000000000006 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.613 HD21 HD23 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 73.209999999999994 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 52.43 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.109999999999999 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.310000000000002 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 62.409999999999997 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.109999999999999 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.439999999999998 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 52.310000000000002 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.310000000000002 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.310000000000002 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.519999999999996 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 55.340000000000003 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 54.229999999999997 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 65.010000000000005 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.340000000000003 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.209999999999994 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.230000000000004 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.415 ' OD1' ' HE2' ' A' ' 63' ' ' LYS . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.519999999999996 110.29 177.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 71.409999999999997 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.511 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 72.349999999999994 111.801 176.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.73 -44.92 88.61 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 63.310000000000002 111.167 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HE2' ' OD1' ' A' ' 59' ' ' ASN . 3.7 mptp? -65.4 -42.98 92.04 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.084 0.469 . . . . 71.530000000000001 110.647 172.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.511 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.5 t90 -60.39 -26.25 66.51 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.962 1.305 . . . . 72.420000000000002 112.109 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -61.74 -36.72 81.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.574 0.75 . . . . 74.230000000000004 112.91 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -78.08 89.96 4.22 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.099 0.476 . . . . 70.209999999999994 111.325 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -72.49 105.31 4.12 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 115.635 -0.711 . . . . 74.409999999999997 109.728 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 70' ' ' PHE . 9.8 tp10 -86.14 -50.62 6.86 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 116.201 -0.454 . . . . 64.530000000000001 112.19 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 61.44 43.62 10.22 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.408 1.099 . . . . 70.439999999999998 110.501 -175.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.447 ' HB2' ' HG3' ' A' ' 68' ' ' GLU . 34.2 t80 -76.06 -36.64 58.92 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.114 -0.948 . . . . 64.209999999999994 112.308 -175.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.37 -173.38 36.92 Favored Glycine 0 C--N 1.348 1.217 0 N-CA-C 114.254 0.462 . . . . 72.340000000000003 114.254 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.12 -18.07 56.11 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.922 0.889 . . . . 60.219999999999999 112.786 -174.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.8 ttm -89.99 86.15 6.52 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 109.634 -0.506 . . . . 55.340000000000003 109.634 173.376 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 56.71 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.034 1.334 . . . . 71.129999999999995 111.457 -175.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 . . . . . 0 N--CA 1.497 1.887 0 C-N-CA 124.768 1.227 . . . . 64.409999999999997 113.92 -173.547 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.9 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.421 0.153 . . . . 73.430000000000007 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -89.28 123.97 33.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.189 0.596 . . . . 71.239999999999995 109.94 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 mmt -79.61 157.78 27.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.789 0.836 . . . . 72.340000000000003 111.867 -177.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.3 t -136.21 163.17 31.01 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.464 0.705 . . . . 63.310000000000002 111.271 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -71.33 139.14 49.76 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 123.711 0.804 . . . . 73.310000000000002 110.254 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.531 ' HD3' ' H ' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -68.87 120.11 14.27 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.456 0.702 . . . . 73.299999999999997 111.15 -174.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.91 -29.94 9.2 Favored Glycine 0 CA--C 1.539 1.554 0 CA-C-N 116.379 -0.373 . . . . 64.230000000000004 113.267 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.81 95.15 6.59 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.533 0.733 . . . . 74.540000000000006 110.012 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -101.56 24.0 10.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.163 0.985 . . . . 75.450000000000003 111.878 -175.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.58 89.5 0.98 Allowed 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.197 0.599 . . . . 70.310000000000002 110.767 -175.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -140.05 126.2 19.85 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.2 1.0 . . . . 75.219999999999999 109.546 174.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -104.76 109.3 21.19 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.489 0.715 . . . . 74.439999999999998 110.815 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -86.22 -6.24 59.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.503 0.721 . . . . 62.539999999999999 112.19 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.2 p -81.64 -57.12 3.59 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.702 0.801 . . . . 61.100000000000001 111.672 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.0 m -127.16 135.57 50.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.124 0.97 . . . . 64.530000000000001 108.561 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 65.58 163.52 0.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.774 1.23 . . . . 43.329999999999998 111.983 -169.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.109999999999999 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 71.430000000000007 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.099999999999994 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.150000000000006 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 64.040000000000006 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.219999999999999 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.54 HD23 HD21 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.129999999999995 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.340000000000003 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 72.530000000000001 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 72.530000000000001 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 44.399999999999999 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 72.420000000000002 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 72.319999999999993 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 63.119999999999997 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.450000000000003 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 72.129999999999995 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.109999999999999 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.445 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.209999999999994 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 53.119999999999997 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 73.129999999999995 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.409999999999997 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.409999999999997 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.340000000000003 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.54 HD21 HD23 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 61.329999999999998 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.530000000000001 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 62.210000000000001 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 72.519999999999996 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.239999999999995 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.030000000000001 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.340000000000003 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.209999999999994 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.210000000000001 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.439999999999998 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 71.420000000000002 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.109999999999999 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.140000000000001 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.239999999999995 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.140000000000001 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 71.209999999999994 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 61.509999999999998 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.219999999999999 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 73.319999999999993 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 51.140000000000001 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.97 83.48 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.239999999999995 110.801 175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -74.17 -24.49 59.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.577 0.751 . . . . 73.340000000000003 112.53 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -75.1 -28.32 60.22 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.276 0.631 . . . . 64.219999999999999 110.624 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -83.1 8.58 12.56 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.77 0.828 . . . . 73.329999999999998 112.729 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -67.5 111.48 4.15 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.129 0.572 . . . . 74.530000000000001 109.905 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -83.29 151.85 25.41 Favored 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 124.443 1.097 . . . . 71.099999999999994 110.859 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 73.84 97.98 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 125.11 1.364 . . . . 51.200000000000003 112.526 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -111.39 111.29 22.23 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.138 0.975 . . . . 75.219999999999999 109.064 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.09 121.73 11.13 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.236 0.614 . . . . 71.430000000000007 111.119 -174.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.54 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.481 1.637 0 C-N-CA 123.045 0.355 . . . . 44.219999999999999 113.68 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 67.68 -83.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.786 1.634 . . . . 72.409999999999997 111.675 178.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.4 ttt 51.81 35.4 15.35 Favored 'General case' 0 CA--C 1.57 1.713 0 C-N-CA 124.125 0.97 . . . . 75.120000000000005 111.666 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -74.47 83.97 1.99 Allowed 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 115.247 -0.888 . . . . 61.32 111.501 -173.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 29.1 tp60 . . . . . 0 CA--C 1.561 1.378 0 C-N-CA 124.726 1.21 . . . . 71.209999999999994 109.065 179.054 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.499 0.19 . . . . 73.109999999999999 111.493 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -166.55 -27.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.136 0.974 . . . . 62.409999999999997 111.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -62.93 -49.09 76.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 73.510000000000005 110.345 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.9 t -114.12 136.94 52.38 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.837 0.855 . . . . 75.099999999999994 109.604 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -101.73 -48.24 4.36 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.217 0.607 . . . . 71.519999999999996 110.819 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 tptm 65.17 140.68 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 125.254 1.422 . . . . 73.319999999999993 113.697 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.05 -143.0 16.22 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.393 -0.367 . . . . 45.200000000000003 113.532 173.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -73.39 145.54 45.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.266 0.626 . . . . 75.120000000000005 112.491 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -155.18 141.36 18.47 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.099 0.96 . . . . 70.299999999999997 109.583 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -64.61 96.79 0.18 Allowed 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.597 0.713 . . . . 71.150000000000006 111.589 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -74.21 -24.12 59.3 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.521 1.128 . . . . 74.319999999999993 111.732 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -62.4 127.37 31.03 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.51 0.724 . . . . 61.399999999999999 111.379 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -93.75 161.04 14.49 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.254 1.022 . . . . 71.319999999999993 111.383 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.5 p -130.42 -70.67 0.61 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.193 0.597 . . . . 62.399999999999999 110.254 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.9 m -111.39 157.04 20.7 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.968 0.907 . . . . 65.319999999999993 109.329 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 67.31 -178.43 0.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.907 1.283 . . . . 64.030000000000001 111.775 -177.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 45.409999999999997 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 63.420000000000002 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.340000000000003 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 63.329999999999998 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.310000000000002 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.409999999999997 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 71.310000000000002 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.209999999999994 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.010000000000005 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.140000000000001 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.239999999999995 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.340000000000003 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 12.9 mm100 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.329999999999998 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.209999999999994 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.239999999999995 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.219999999999999 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.530000000000001 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.140000000000001 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.299999999999997 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.420000000000002 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 71.230000000000004 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 41.439999999999998 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 72.120000000000005 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 72.219999999999999 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 64.230000000000004 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 52.219999999999999 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.420000000000002 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.519999999999996 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 70.439999999999998 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.329999999999998 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.010000000000005 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.099999999999994 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.200000000000003 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.519999999999996 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.099999999999994 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 72.349999999999994 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.230000000000004 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 73.239999999999995 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.435 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 63.439999999999998 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.409 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.340000000000003 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 73.409999999999997 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 60.329999999999998 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 70.5 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.329999999999998 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.89 86.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 51.539999999999999 111.721 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG2' HE22 ' A' ' 72' ' ' GLN . 86.2 mttt -82.94 -24.58 32.96 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.406 0.682 . . . . 75.030000000000001 111.756 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 72.0 t90 -78.26 -53.3 7.47 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.498 1.119 . . . . 73.310000000000002 111.318 -178.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -89.05 66.07 7.67 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-O 122.229 1.014 . . . . 73.129999999999995 111.275 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -137.48 144.92 42.48 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.112 0.965 . . . . 51.420000000000002 109.274 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -73.75 -40.05 63.79 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 73.140000000000001 109.798 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.65 124.42 27.91 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.527 -1.286 . . . . 75.549999999999997 107.527 160.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -161.36 -41.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.6 0.636 . . . . 74.049999999999997 112.351 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -50.36 -54.36 22.23 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 124.353 1.061 . . . . 74.030000000000001 112.259 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -113.42 72.15 0.23 Allowed Glycine 0 N--CA 1.47 0.938 0 CA-C-N 115.63 -0.714 . . . . 35.119999999999997 111.33 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.446 HE22 ' HG2' ' A' ' 63' ' ' LYS . 53.2 tt0 -66.27 111.58 3.54 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.967 0.507 . . . . 73.420000000000002 110.696 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 53.3 mtm -65.35 106.55 1.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.154 0.982 . . . . 74.549999999999997 112.144 -171.623 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -141.92 137.03 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.593 -0.892 . . . . 75.409999999999997 108.593 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.844 0.858 . . . . 72.230000000000004 112.364 -173.156 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.4 p . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.675 0.274 . . . . 64.120000000000005 111.051 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -123.83 124.29 42.34 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.776 0.83 . . . . 74.420000000000002 109.511 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.29 156.84 18.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 74.150000000000006 111.573 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.9 m -146.14 103.02 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.064 0.946 . . . . 62.140000000000001 109.04 173.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.6 p-10 -75.57 -6.42 50.2 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 113.412 0.893 . . . . 71.239999999999995 113.412 -172.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -103.68 114.04 28.01 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.771 0.829 . . . . 71.420000000000002 110.898 178.086 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.49 71.01 2.89 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 111.895 -0.482 . . . . 72.219999999999999 111.895 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -78.8 130.0 35.24 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.596 0.758 . . . . 61.039999999999999 112.197 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -75.91 106.44 7.49 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 122.953 0.501 . . . . 72.510000000000005 110.755 174.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -157.5 -76.01 0.09 Allowed 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 109.665 -0.494 . . . . 74.299999999999997 109.665 172.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -136.56 142.25 43.38 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.615 0.766 . . . . 74.310000000000002 110.478 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -96.44 60.73 1.93 Allowed 'General case' 0 CA--C 1.556 1.187 0 N-CA-C 107.852 -1.166 . . . . 73.310000000000002 107.852 166.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 64.11 10.23 5.29 Favored 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 125.37 1.468 . . . . 72.450000000000003 112.184 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.1 p -80.26 93.9 5.98 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.934 0.894 . . . . 73.030000000000001 111.73 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.7 p -94.38 1.77 55.82 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.204 0.601 . . . . 74.329999999999998 111.536 172.235 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.28 160.09 23.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.245 1.018 . . . . 74.510000000000005 111.251 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.519999999999996 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 51.420000000000002 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.150000000000006 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.439999999999998 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.340000000000003 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.319999999999993 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 64.120000000000005 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.674 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.439999999999998 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.510000000000005 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 62.030000000000001 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 53.030000000000001 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 73.349999999999994 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 55.210000000000001 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 72.349999999999994 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.774 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.430000000000007 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.150000000000006 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.400000000000006 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.219999999999999 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 73.420000000000002 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 71.120000000000005 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 72.510000000000005 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 55.149999999999999 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.319999999999993 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.319999999999993 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.674 HD21 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.430000000000007 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.030000000000001 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 72.519999999999996 112.628 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 71.319999999999993 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 62.009999999999998 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 44.130000000000003 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.230000000000004 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.310000000000002 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.219999999999999 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 73.400000000000006 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.420000000000002 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.239999999999995 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.430000000000007 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 62.399999999999999 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.230000000000004 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.299999999999997 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 54.229999999999997 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 42.520000000000003 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.329999999999998 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.774 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.019999999999996 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.67 -41.01 84.38 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.319999999999993 110.59 172.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -80.73 -27.11 36.99 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.939 0.895 . . . . 74.200000000000003 111.998 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.531 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.2 t90 -73.37 -33.81 65.25 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.531 0.732 . . . . 73.430000000000007 110.141 174.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -78.91 -30.25 44.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 73.25 111.007 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -143.25 107.84 4.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.406 0.682 . . . . 72.230000000000004 109.831 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.7 ttp180 -43.99 -61.95 1.29 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.838 1.655 . . . . 64.25 114.359 -171.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 55.96 65.87 1.34 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.65 1.18 . . . . 73.340000000000003 112.925 -175.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -171.06 103.07 0.22 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.845 -1.07 . . . . 74.230000000000004 109.902 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -94.19 -17.5 22.66 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.444 0.698 . . . . 72.239999999999995 111.518 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.08 -107.26 3.42 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 116.307 -0.406 . . . . 64.420000000000002 112.855 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -125.68 136.85 53.67 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.792 0.837 . . . . 52.109999999999999 111.198 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 83.2 mtp -77.68 99.35 5.79 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.343 0.657 . . . . 73.010000000000005 110.483 173.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -86.38 96.39 9.99 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.275 0.63 . . . . 72.219999999999999 111.504 -176.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 124.447 1.099 . . . . 71.120000000000005 110.038 170.751 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.597 0.237 . . . . 71.230000000000004 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.29 162.76 26.53 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.312 0.645 . . . . 75.450000000000003 112.109 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 47.1 ttp 72.35 -1.75 2.83 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.954 1.301 . . . . 75.150000000000006 112.297 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -115.37 83.49 1.93 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.874 0.869 . . . . 72.439999999999998 109.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -111.36 95.15 5.34 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.772 0.829 . . . . 73.049999999999997 110.868 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -153.7 135.41 14.46 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.02 0.928 . . . . 73.310000000000002 109.321 175.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.43 165.89 51.47 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 121.605 -0.331 . . . . 52.299999999999997 112.553 171.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 63.84 96.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.661 1.185 . . . . 74.400000000000006 112.559 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -96.93 139.3 33.17 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.437 0.695 . . . . 63.109999999999999 110.246 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -146.75 -64.51 0.29 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 122.143 -0.348 . . . . 74.150000000000006 111.743 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -83.24 -1.39 53.0 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 122.975 0.51 . . . . 74.140000000000001 112.024 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -62.58 142.7 57.88 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.384 0.674 . . . . 75.109999999999999 112.086 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -66.92 100.16 0.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.182 0.593 . . . . 74.230000000000004 111.227 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.8 m -101.03 -47.94 4.59 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.417 -0.811 . . . . 75.340000000000003 111.514 -174.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.9 p -96.58 -62.45 1.27 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.464 0.706 . . . . 51.020000000000003 111.266 -176.225 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -97.84 135.2 39.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.631 0.772 . . . . 64.010000000000005 110.01 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.239999999999995 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.219999999999999 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 55.340000000000003 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.019999999999996 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 62.439999999999998 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.219999999999999 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 73.540000000000006 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.049999999999997 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 51.439999999999998 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 70.209999999999994 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 61.140000000000001 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.409999999999997 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.420000000000002 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 74.340000000000003 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.150000000000006 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 72.510000000000005 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 32.32 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 61.229999999999997 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 65.299999999999997 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.310000000000002 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.200000000000003 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 64.010000000000005 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 71.310000000000002 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 15.5 mm100 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 64.049999999999997 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.420000000000002 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.310000000000002 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.420000000000002 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.530000000000001 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.340000000000003 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.409999999999997 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.129999999999995 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 70.030000000000001 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.209999999999994 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 65.200000000000003 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 65.430000000000007 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.349999999999994 110.663 172.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 40.340000000000003 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.129999999999995 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.109999999999999 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 72.319999999999993 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.239999999999995 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.510000000000005 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 73.25 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.82 85.59 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.009999999999998 111.794 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.26 -25.22 34.27 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.085 0.554 . . . . 74.540000000000006 110.807 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.2 t90 -68.36 -30.25 69.15 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.056 0.942 . . . . 74.319999999999993 111.196 168.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -73.71 117.85 15.97 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.798 0.839 . . . . 70.340000000000003 109.959 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -67.0 133.91 50.89 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.022 0.529 . . . . 75.439999999999998 112.249 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 60.93 97.12 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 125.121 1.368 . . . . 54.0 111.616 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.11 122.56 18.54 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.729 -0.669 . . . . 64.129999999999995 110.021 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -59.03 97.47 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.669 0.788 . . . . 65.549999999999997 111.045 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 t80 56.95 45.34 21.44 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 124.576 1.15 . . . . 75.310000000000002 111.22 -174.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.28 -74.59 1.1 Allowed Glycine 0 C--N 1.351 1.376 0 CA-C-N 115.794 -0.639 . . . . 52.32 112.599 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.71 4.05 50.06 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.345 0.658 . . . . 74.030000000000001 112.134 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.3 mtm 68.67 143.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.406 1.482 . . . . 73.239999999999995 112.477 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 66.04 106.47 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.471 1.108 . . . . 72.549999999999997 112.056 176.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.573 1.835 0 C-N-CA 124.494 1.117 . . . . 74.200000000000003 111.879 -173.744 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.467 0.175 . . . . 72.109999999999999 111.168 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -101.72 132.5 47.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.468 0.707 . . . . 74.510000000000005 109.736 175.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -64.93 123.54 19.71 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.225 0.61 . . . . 60.100000000000001 110.84 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.5 p -80.41 92.34 5.82 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.346 0.658 . . . . 54.32 111.405 -175.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -107.26 96.38 6.38 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.407 0.683 . . . . 74.019999999999996 109.813 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -114.48 115.48 27.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.704 0.802 . . . . 65.099999999999994 109.043 176.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.54 51.04 4.11 Favored Glycine 0 N--CA 1.479 1.559 0 N-CA-C 114.338 0.495 . . . . 74.129999999999995 114.338 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -99.73 84.85 2.99 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.574 0.75 . . . . 71.400000000000006 109.326 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 110.76 6.91 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.992 0.917 . . . . 63.5 109.085 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 63.4 mtt-85 -91.96 -93.52 0.14 Allowed 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 122.953 0.501 . . . . 71.340000000000003 110.051 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 174.77 141.54 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.273 1.429 . . . . 72.420000000000002 109.945 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.82 130.42 36.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.096 0.558 . . . . 73.530000000000001 110.441 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.6 ttp180 -89.45 121.54 31.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.822 -0.807 . . . . 73.540000000000006 108.822 173.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.7 p -66.42 101.84 0.8 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.516 0.726 . . . . 62.200000000000003 111.893 -171.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.7 p -73.91 121.3 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.062 0.945 . . . . 55.310000000000002 110.923 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 60.77 -165.62 0.21 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 124.119 0.967 . . . . 74.340000000000003 111.364 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.120000000000005 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.120000000000005 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.540000000000006 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 64.439999999999998 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 71.540000000000006 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.409999999999997 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.458 HD23 HD21 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 62.299999999999997 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.209999999999994 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 61.329999999999998 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.400000000000006 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.120000000000005 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.239999999999995 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 64.420000000000002 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 61.439999999999998 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 71.109999999999999 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.200000000000003 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.030000000000001 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 63.240000000000002 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 62.539999999999999 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 53.130000000000003 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.209999999999994 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.430000000000007 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 65.340000000000003 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD21 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 72.340000000000003 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.150000000000006 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 53.450000000000003 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.310000000000002 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 72.030000000000001 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 65.510000000000005 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 54.539999999999999 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 73.120000000000005 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.219999999999999 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 53.009999999999998 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.430000000000007 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 45.25 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 64.540000000000006 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 53.520000000000003 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 72.329999999999998 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.606 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 72.219999999999999 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.150000000000006 110.933 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.430000000000007 110.225 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.099999999999994 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.606 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.310000000000002 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.46 69.04 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 64.010000000000005 111.134 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' ASN . 64.2 mttm -84.07 -30.61 25.89 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.85 0.86 . . . . 62.409999999999997 111.635 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -65.72 -46.35 79.26 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.774 0.829 . . . . 74.299999999999997 111.337 -172.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -81.26 164.61 22.12 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 109.552 -0.536 . . . . 74.319999999999993 109.552 172.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -76.83 80.19 3.42 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.676 0.75 . . . . 72.209999999999994 112.855 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -102.51 125.34 49.2 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.656 1.183 . . . . 64.239999999999995 109.439 171.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -90.67 -58.07 2.61 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.164 0.586 . . . . 73.349999999999994 111.126 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -148.23 -37.15 0.19 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.203 0.601 . . . . 74.329999999999998 111.849 -172.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -60.6 126.44 27.45 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.621 0.769 . . . . 63.310000000000002 111.639 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.1 16.56 3.53 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 115.924 -0.58 . . . . 70.430000000000007 112.675 -172.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -83.85 137.17 33.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.37 0.668 . . . . 75.120000000000005 111.904 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.2 ptt? -157.34 118.53 3.63 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.104 0.961 . . . . 61.450000000000003 109.488 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -86.87 -63.8 1.25 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 120.962 0.411 . . . . 71.219999999999999 111.114 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 . . . . . 0 CA--C 1.562 1.423 0 C-N-CA 123.784 0.834 . . . . 61.409999999999997 111.246 -176.307 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.794 0.33 . . . . 54.229999999999997 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -161.47 101.05 1.19 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.706 0.802 . . . . 73.409999999999997 109.461 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.6 ptm -104.56 114.53 28.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.182 0.593 . . . . 72.140000000000001 110.774 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.7 m -135.65 131.23 35.5 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.501 0.72 . . . . 74.209999999999994 110.559 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -77.73 160.32 28.5 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 121.241 0.543 . . . . 73.219999999999999 111.592 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 95.49 7.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.78 0.832 . . . . 72.340000000000003 109.858 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.55 73.05 2.29 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 116.27 -0.423 . . . . 74.450000000000003 112.709 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -115.71 151.47 35.03 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.816 0.846 . . . . 73.329999999999998 112.039 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -104.05 116.36 32.09 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.553 0.741 . . . . 73.129999999999995 110.14 177.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -91.63 153.77 19.48 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.435 0.694 . . . . 62.210000000000001 112.305 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtm105 -81.3 109.78 16.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.874 0.87 . . . . 75.299999999999997 110.629 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -99.02 -13.49 19.86 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.988 0.515 . . . . 74.329999999999998 111.53 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 -67.73 0.97 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.593 0.757 . . . . 73.340000000000003 109.222 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.5 m 67.48 93.49 0.07 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.155 1.382 . . . . 74.420000000000002 112.217 -172.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.1 m -139.56 -54.59 0.56 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.625 1.17 . . . . 65.299999999999997 107.843 167.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 -115.14 141.57 47.83 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 114.389 -1.278 . . . . 71.409999999999997 108.509 170.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 54.25 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.310000000000002 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.219999999999999 111.14 -178.421 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 52.450000000000003 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.239999999999995 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 54.549999999999997 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' GLN . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.329999999999998 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 71.239999999999995 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 64.120000000000005 110.926 173.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 65.420000000000002 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 65.329999999999998 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.230000000000004 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 63.539999999999999 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.129999999999995 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 64.540000000000006 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.099999999999994 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.219999999999999 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.120000000000005 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 71.430000000000007 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 61.130000000000003 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.749 HH11 HG12 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 72.310000000000002 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.420000000000002 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 65.319999999999993 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 63.140000000000001 112.264 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 53.43 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.450000000000003 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.329999999999998 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.430000000000007 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 74.140000000000001 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.239999999999995 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 70.109999999999999 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.441 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 72.219999999999999 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 52.219999999999999 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 74.010000000000005 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.749 HG12 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 64.310000000000002 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 64.129999999999995 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.530000000000001 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.329999999999998 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 71.310000000000002 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.019999999999996 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 72.219999999999999 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 73.010000000000005 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.400000000000006 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.44 84.91 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.539999999999999 111.317 173.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -73.75 -25.77 60.33 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.582 0.753 . . . . 74.420000000000002 111.466 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -70.89 -49.16 48.94 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.207 0.603 . . . . 73.200000000000003 110.735 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 30.3 mtm-85 -71.06 115.87 10.7 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.371 0.669 . . . . 73.430000000000007 111.053 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -71.49 123.79 23.2 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 123.192 0.597 . . . . 73.129999999999995 112.446 -174.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.49 25.21 14.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.617 1.567 . . . . 75.120000000000005 113.07 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -74.46 155.76 37.67 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.584 0.754 . . . . 71.099999999999994 110.588 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 73.58 118.35 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 125.299 1.44 . . . . 71.129999999999995 111.317 -172.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -135.27 152.92 51.96 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.705 0.802 . . . . 51.409999999999997 110.918 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.9 73.08 2.35 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 116.357 -0.383 . . . . 62.520000000000003 114.037 -175.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -91.38 115.25 27.88 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.498 0.719 . . . . 75.040000000000006 110.593 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.58 67.32 0.76 Allowed 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.351 -0.981 . . . . 70.450000000000003 108.351 171.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -99.86 97.52 8.41 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.966 0.906 . . . . 64.010000000000005 110.401 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.258 1.521 0 C-N-CA 123.397 0.679 . . . . 74.450000000000003 109.801 175.45 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 81.1 p . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.934 -0.079 . . . . 74.209999999999994 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -164.35 -29.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.362 0.665 . . . . 73.25 111.601 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -64.61 140.7 58.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.105 0.562 . . . . 72.099999999999994 111.919 -177.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.4 m -93.77 -38.52 11.23 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.685 0.794 . . . . 64.299999999999997 111.086 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.73 100.27 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 124.65 1.18 . . . . 74.239999999999995 112.289 176.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.93 90.28 1.93 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.475 0.71 . . . . 74.420000000000002 109.22 177.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.49 72.68 0.09 OUTLIER Glycine 0 N--CA 1.471 1.002 0 CA-C-N 115.716 -0.675 . . . . 72.129999999999995 111.531 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -55.67 -52.4 63.97 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.245 1.018 . . . . 74.400000000000006 111.534 -175.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt 60.97 93.45 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 124.322 1.049 . . . . 74.400000000000006 111.75 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -67.59 -16.11 64.01 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.646 1.179 . . . . 75.120000000000005 113.721 -173.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.8 ttt180 -70.22 -77.66 0.08 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.455 0.702 . . . . 74.109999999999999 112.855 -170.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -92.16 138.74 31.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.357 0.663 . . . . 54.399999999999999 111.25 -174.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -85.07 74.0 10.57 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.611 0.765 . . . . 74.400000000000006 110.436 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.3 m -70.75 87.91 0.7 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.835 0.854 . . . . 75.549999999999997 109.737 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.1 t -109.56 18.4 20.36 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.28 1.032 . . . . 74.5 111.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -75.8 124.52 27.44 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.526 0.73 . . . . 75.340000000000003 110.913 -175.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.409999999999997 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.340000000000003 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.510000000000005 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 73.140000000000001 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 64.109999999999999 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.019999999999996 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 71.319999999999993 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 72.409999999999997 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 61.450000000000003 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.219999999999999 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.230000000000004 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 50.340000000000003 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.409999999999997 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.340000000000003 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 53.340000000000003 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 52.149999999999999 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.329999999999998 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.510000000000005 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.549999999999997 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 63.140000000000001 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.129999999999995 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.400000000000006 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 64.530000000000001 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 43.399999999999999 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 74.450000000000003 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD21 HD23 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.510000000000005 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 65.129999999999995 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.229999999999997 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 72.129999999999995 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.450000000000003 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.420000000000002 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 60.149999999999999 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 72.329999999999998 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 73.349999999999994 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.200000000000003 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.209999999999994 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.475 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 64.310000000000002 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 71.420000000000002 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 71.319999999999993 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.400000000000006 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.310000000000002 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.310000000000002 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.2 m-80 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.319999999999993 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.400000000000006 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 72.540000000000006 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.68 -48.04 78.76 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 65.010000000000005 110.696 175.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.41 -31.66 72.02 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.802 0.841 . . . . 75.540000000000006 112.202 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -68.77 -36.36 78.23 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.928 0.891 . . . . 74.109999999999999 110.861 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.42 -52.69 24.46 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 116.256 -0.429 . . . . 74.409999999999997 110.1 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -164.96 -61.86 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 115.973 -0.558 . . . . 63.439999999999998 111.04 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -161.72 164.42 29.06 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.54 0.736 . . . . 64.310000000000002 111.52 -171.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -109.1 -26.62 10.05 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 114.298 1.222 . . . . 75.030000000000001 114.298 -169.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -65.82 -27.17 68.05 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 113.081 0.771 . . . . 60.439999999999998 113.081 -170.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -78.38 1.51 21.76 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 123.486 0.714 . . . . 73.340000000000003 112.244 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.18 110.52 3.49 Favored Glycine 0 C--N 1.358 1.787 0 C-N-CA 122.916 0.293 . . . . 51.210000000000001 113.24 176.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -74.16 134.95 42.82 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.545 0.738 . . . . 63.009999999999998 112.595 -170.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -143.19 155.42 44.54 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.693 0.797 . . . . 75.400000000000006 111.057 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -89.97 110.22 21.21 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.003 0.521 . . . . 54.229999999999997 110.107 176.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 . . . . . 0 CA--C 1.574 1.88 0 C-N-CA 124.999 1.319 . . . . 65.299999999999997 112.675 179.357 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 110.406 -0.22 . . . . 75.0 110.406 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 26.1 p80 -62.46 145.98 52.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.988 0.515 . . . . 75.109999999999999 111.837 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.45 116.9 13.73 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 108.837 -0.801 . . . . 61.140000000000001 108.837 173.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -106.66 135.03 48.89 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.139 0.976 . . . . 73.439999999999998 110.378 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -117.79 122.07 42.46 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.644 0.778 . . . . 73.150000000000006 110.555 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.01 78.67 3.55 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.374 0.607 . . . . 74.340000000000003 110.513 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.39 177.39 45.35 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.635 -0.711 . . . . 21.030000000000001 112.866 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt 59.27 29.06 18.56 Favored 'General case' 0 N--CA 1.497 1.925 0 C-N-CA 124.037 0.935 . . . . 75.010000000000005 111.925 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -77.96 17.72 0.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.509 1.124 . . . . 61.530000000000001 113.699 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.2 ttt180 -76.92 -9.59 58.79 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 122.947 0.499 . . . . 64.129999999999995 110.758 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.1 mmt180 -84.76 87.52 7.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.563 0.745 . . . . 72.0 111.404 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -100.3 119.9 39.11 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.592 0.757 . . . . 75.010000000000005 109.281 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.3 ttt-85 -124.56 135.75 53.41 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.186 0.594 . . . . 63.240000000000002 110.268 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -87.92 61.15 6.23 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.769 0.828 . . . . 74.5 111.562 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -77.22 84.0 3.69 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.415 0.686 . . . . 61.240000000000002 109.722 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 62.06 -179.83 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.749 1.219 . . . . 70.310000000000002 112.235 -175.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 53.25 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 63.420000000000002 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.439999999999998 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.530000000000001 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.430000000000007 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.340000000000003 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.420000000000002 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 65.010000000000005 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 61.439999999999998 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.150000000000006 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 71.019999999999996 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 72.049999999999997 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 62.420000000000002 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 64.540000000000006 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 71.340000000000003 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.464 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.430000000000007 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.329999999999998 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.409999999999997 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 71.530000000000001 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.230000000000004 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 72.510000000000005 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.209999999999994 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 71.219999999999999 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.019999999999996 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 44.409999999999997 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.010000000000005 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.349999999999994 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 72.439999999999998 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.430000000000007 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.450000000000003 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 74.109999999999999 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 70.219999999999999 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 34.530000000000001 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.420000000000002 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 62.299999999999997 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 17.0 mm100 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.340000000000003 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 60.100000000000001 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.450000000000003 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 74.319999999999993 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 54.229999999999997 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.530000000000001 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.430000000000007 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.27 90.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 63.539999999999999 111.34 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.78 -31.56 25.84 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.988 0.915 . . . . 74.030000000000001 111.937 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -71.54 -34.69 70.25 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.525 1.13 . . . . 63.450000000000003 111.363 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.03 -34.57 77.85 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.812 0.845 . . . . 65.030000000000001 111.893 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -146.05 93.5 2.34 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.143 0.577 . . . . 74.340000000000003 110.488 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -93.76 126.29 38.86 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.062 0.545 . . . . 74.219999999999999 110.512 176.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -159.66 -170.52 2.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.85 0.86 . . . . 71.310000000000002 110.69 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -75.87 177.76 6.72 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.32 0.648 . . . . 71.040000000000006 111.626 176.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -66.96 -43.71 82.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.46 0.304 . . . . 74.25 111.575 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.54 136.49 6.59 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-N 116.142 -0.481 . . . . 72.439999999999998 113.089 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.61 83.47 1.29 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 108.742 -0.836 . . . . 63.329999999999998 108.742 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 ttm -157.14 -53.98 0.08 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.024 0.929 . . . . 72.340000000000003 109.699 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -142.6 80.91 1.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.658 0.742 . . . . 71.310000000000002 109.682 174.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 . . . . . 0 CA--C 1.566 1.579 0 CA-C-N 115.167 -0.924 . . . . 72.5 108.972 172.464 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.669 0.271 . . . . 55.240000000000002 111.616 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.2 160.03 39.68 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.468 0.707 . . . . 75.530000000000001 111.507 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 51.2 tpp -152.72 150.87 29.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.976 0.511 . . . . 63.210000000000001 111.427 -176.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.3 p -88.21 -173.12 4.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.165 0.986 . . . . 70.439999999999998 112.204 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -62.99 110.95 1.96 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.834 0.454 . . . . 65.319999999999993 110.712 171.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -83.32 60.14 5.42 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.18 0.992 . . . . 72.430000000000007 112.102 -173.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 71.42 -73.28 0.75 Allowed Glycine 0 CA--C 1.537 1.456 0 N-CA-C 114.045 0.378 . . . . 51.520000000000003 114.045 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 8' ' ' LYS . 8.6 mtmp? 68.32 82.1 0.18 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.088 1.355 . . . . 74.530000000000001 111.583 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.1 22.17 0.43 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.405 0.682 . . . . 74.430000000000007 111.26 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp-105 -92.7 120.32 32.98 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.537 0.735 . . . . 74.430000000000007 111.709 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 ptt180 -86.6 135.81 33.29 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.852 0.461 . . . . 75.129999999999995 110.791 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.0 172.14 11.54 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.378 0.671 . . . . 75.129999999999995 112.313 -175.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -158.09 66.87 0.47 Allowed 'General case' 0 CA--C 1.557 1.237 0 CA-C-O 121.56 0.695 . . . . 72.319999999999993 112.375 -173.065 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.3 p -134.66 75.1 1.56 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.709 -0.619 . . . . 75.129999999999995 111.327 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -77.41 -58.64 3.16 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.26 0.624 . . . . 63.119999999999997 110.927 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 66.16 153.85 0.08 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.257 1.423 . . . . 60.43 112.899 -176.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 63.530000000000001 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 44.219999999999999 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.409999999999997 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.510000000000005 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 71.540000000000006 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.150000000000006 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.099999999999994 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.539 HD23 HD21 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 70.439999999999998 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.150000000000006 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 62.329999999999998 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.349999999999994 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.439999999999998 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.209999999999994 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 64.200000000000003 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.420000000000002 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.409999999999997 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.409999999999997 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 64.450000000000003 113.739 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.019999999999996 112.512 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.540000000000006 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 71.200000000000003 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 51.219999999999999 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.418 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 63.340000000000003 111.231 176.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.409999999999997 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 65.420000000000002 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD21 HD23 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.140000000000001 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 60.119999999999997 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 71.239999999999995 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 60.420000000000002 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.624 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 41.43 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 74.329999999999998 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.120000000000005 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.409999999999997 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.230000000000004 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.409999999999997 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HD3' HD22 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 54.409999999999997 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 63.539999999999999 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.430000000000007 112.468 177.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.140000000000001 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 72.299999999999997 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 71.200000000000003 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.230000000000004 109.951 177.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.420000000000002 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 62.210000000000001 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.409999999999997 111.875 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.94 86.95 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 32.439999999999998 110.559 172.064 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -72.63 -30.24 64.16 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.715 0.806 . . . . 72.549999999999997 111.875 174.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.1 t90 -62.2 -36.86 83.23 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.284 0.634 . . . . 61.109999999999999 110.485 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -88.17 167.4 13.64 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.432 0.693 . . . . 75.310000000000002 111.283 172.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.483 ' HG3' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -83.63 -15.21 49.86 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 114.082 1.141 . . . . 71.549999999999997 114.082 -172.136 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.483 ' HG3' ' HG3' ' A' ' 66' ' ' LYS . 99.5 mtt180 -123.76 133.86 53.76 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 112.392 0.515 . . . . 75.239999999999995 112.392 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -85.72 -49.46 7.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.465 1.106 . . . . 73.310000000000002 108.874 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -98.0 122.9 41.69 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.869 -1.059 . . . . 74.25 108.306 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -58.46 -47.21 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 112.875 0.694 . . . . 72.299999999999997 112.875 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 172.04 83.15 0.05 OUTLIER Glycine 0 CA--C 1.529 0.909 0 CA-C-N 116.593 -0.276 . . . . 70.340000000000003 112.462 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -148.85 157.42 43.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.185 0.594 . . . . 74.010000000000005 111.56 -176.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.9 ttt -143.65 138.08 28.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.719 0.808 . . . . 64.329999999999998 110.411 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -147.34 34.38 0.88 Allowed 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.855 0.862 . . . . 70.329999999999998 109.269 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 . . . . . 0 CA--C 1.576 1.977 0 C-N-CA 125.199 1.399 . . . . 73.299999999999997 112.877 -179.405 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.453 0.168 . . . . 73.239999999999995 111.188 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -151.73 143.85 23.93 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.034 0.534 . . . . 73.209999999999994 111.132 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -76.23 117.19 17.66 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.102 0.561 . . . . 72.510000000000005 111.03 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.2 t -170.86 172.61 5.54 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.958 0.903 . . . . 72.400000000000006 110.59 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -75.7 95.79 3.48 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.855 0.462 . . . . 73.099999999999994 109.78 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -124.07 61.38 1.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.078 0.951 . . . . 74.340000000000003 111.914 -172.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.67 62.99 3.63 Favored Glycine 0 N--CA 1.477 1.38 0 CA-C-N 115.71 -0.677 . . . . 44.310000000000002 112.465 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -85.49 100.29 11.79 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.341 0.656 . . . . 72.209999999999994 111.408 -175.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -137.8 104.3 5.25 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.316 0.646 . . . . 73.219999999999999 111.212 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 62.98 123.07 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.599 1.56 . . . . 62.210000000000001 113.759 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -80.5 100.8 8.72 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.36 0.664 . . . . 72.439999999999998 112.239 -176.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -102.86 -80.15 0.52 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.235 -1.024 . . . . 61.409999999999997 108.235 165.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtt-85 -135.84 50.94 2.07 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.571 1.148 . . . . 73.019999999999996 109.186 171.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -93.34 79.59 4.42 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.938 0.875 . . . . 73.219999999999999 110.871 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -116.76 -60.52 1.84 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.138 0.975 . . . . 72.409999999999997 111.324 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -122.99 129.88 52.09 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.482 0.713 . . . . 75.430000000000007 111.529 -177.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 62.140000000000001 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 53.530000000000001 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 71.299999999999997 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.643 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 70.040000000000006 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.329999999999998 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.140000000000001 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 63.119999999999997 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 63.420000000000002 111.128 176.44 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.120000000000005 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 63.340000000000003 111.816 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.329999999999998 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 73.549999999999997 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.349999999999994 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.019999999999996 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.030000000000001 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 62.5 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 72.510000000000005 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.129999999999995 112.924 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.519999999999996 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 62.5 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.310000000000002 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.129999999999995 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 73.140000000000001 111.385 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.310000000000002 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 62.43 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 62.350000000000001 110.964 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 63.299999999999997 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 53.539999999999999 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.120000000000005 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.643 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 64.549999999999997 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.340000000000003 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.424 ' HG ' HE21 ' A' ' 20' ' ' GLN . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 71.409999999999997 112.079 -178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 60.229999999999997 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.430000000000007 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.420000000000002 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.420000000000002 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 65.200000000000003 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.420000000000002 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 55.420000000000002 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.120000000000005 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.310000000000002 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.150000000000006 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 63.439999999999998 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.049999999999997 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 74.140000000000001 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.38 70.44 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 74.400000000000006 111.491 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -80.91 -49.32 11.16 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.902 0.881 . . . . 72.25 111.181 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -70.27 -54.98 10.38 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.571 1.149 . . . . 71.549999999999997 111.815 -173.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -73.4 86.81 1.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.917 0.487 . . . . 63.329999999999998 109.743 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -144.26 114.8 7.63 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.164 0.586 . . . . 65.239999999999995 110.967 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -90.38 -20.79 22.43 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.348 1.059 . . . . 74.209999999999994 111.358 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 80.65 144.93 0.08 Allowed 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 126.068 1.747 . . . . 74.349999999999994 111.0 -163.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -106.84 167.81 9.62 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.822 0.849 . . . . 55.420000000000002 111.674 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -77.03 156.23 31.97 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.487 -0.779 . . . . 73.450000000000003 109.48 165.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -85.29 -114.91 0.77 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.367 -0.293 . . . . 45.32 112.367 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -166.16 -52.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.997 0.919 . . . . 65.450000000000003 109.473 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.4 ttm -155.07 -47.08 0.08 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.057 0.543 . . . . 74.439999999999998 110.679 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.2 60.6 3.11 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.178 0.991 . . . . 53.539999999999999 111.088 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 CA--C 1.571 1.773 0 CA-C-N 114.34 -1.3 . . . . 72.049999999999997 111.737 -176.831 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 121.093 0.473 . . . . 41.109999999999999 110.661 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -79.99 130.97 35.69 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.139 0.576 . . . . 74.099999999999994 110.188 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.68 -165.34 1.94 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.241 0.616 . . . . 64.230000000000004 111.397 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m 73.67 4.56 4.75 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.129 1.371 . . . . 71.25 113.711 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -79.81 101.92 8.78 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.95 0.5 . . . . 62.399999999999999 111.416 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -130.36 93.2 3.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.894 0.877 . . . . 73.239999999999995 110.089 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.88 -165.87 26.81 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.653 -0.703 . . . . 43.219999999999999 113.066 176.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.37 117.62 22.57 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.875 0.47 . . . . 75.319999999999993 110.532 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -85.58 31.45 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.652 0.781 . . . . 74.230000000000004 111.223 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -79.38 100.33 7.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.109 0.963 . . . . 60.229999999999997 110.312 -174.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -73.29 78.27 1.33 Allowed 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 121.385 0.612 . . . . 74.450000000000003 109.951 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -79.12 93.16 5.13 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.762 -0.653 . . . . 64.299999999999997 110.58 -177.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -146.45 71.61 1.25 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.435 -0.95 . . . . 72.409999999999997 108.435 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.3 t -155.85 9.55 0.27 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 114.833 -1.076 . . . . 53.409999999999997 111.089 -178.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.7 m -111.28 -67.22 1.01 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.151 0.98 . . . . 64.310000000000002 111.566 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -88.16 132.48 34.32 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.419 0.688 . . . . 61.340000000000003 111.238 -175.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 61.130000000000003 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 62.210000000000001 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.109999999999999 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.150000000000006 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 63.240000000000002 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.140000000000001 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 62.409999999999997 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.584 HD23 HD21 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.329999999999998 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 63.43 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 53.140000000000001 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 63.229999999999997 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.109999999999999 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.010000000000005 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.219999999999999 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 71.439999999999998 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.319999999999993 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.689 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.310000000000002 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.319999999999993 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 73.140000000000001 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.109999999999999 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 73.150000000000006 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.510000000000005 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 71.040000000000006 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 71.450000000000003 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.584 HD21 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 61.149999999999999 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 63.210000000000001 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.409999999999997 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 73.099999999999994 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.556 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 63.229999999999997 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.120000000000005 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.140000000000001 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 61.229999999999997 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 72.540000000000006 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.310000000000002 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.658 ' HG2' HD22 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.209999999999994 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.040000000000006 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.540000000000006 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 72.209999999999994 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.030000000000001 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.040000000000006 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.409999999999997 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 61.439999999999998 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.540000000000006 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.689 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.319999999999993 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.67 -39.92 90.2 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 54.049999999999997 111.518 177.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -79.54 -32.61 42.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.812 0.445 . . . . 74.140000000000001 111.472 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -60.46 -38.69 85.0 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.205 0.602 . . . . 63.329999999999998 110.609 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -93.23 -18.37 22.58 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.49 0.716 . . . . 73.420000000000002 111.567 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.7 pttp 40.14 56.06 2.6 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 126.488 1.915 . . . . 64.439999999999998 113.642 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -100.72 132.31 46.18 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 114.365 -1.289 . . . . 65.329999999999998 111.615 -175.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -66.08 131.89 47.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.941 0.496 . . . . 72.010000000000005 110.133 169.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -155.48 89.25 1.18 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.16 0.584 . . . . 73.530000000000001 110.17 -173.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -64.47 138.95 58.69 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.51 0.724 . . . . 74.519999999999996 111.855 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -91.71 148.45 19.26 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.359 -0.382 . . . . 40.210000000000001 113.849 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -106.76 31.53 5.21 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 124.367 1.067 . . . . 73.010000000000005 111.243 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 50.3 ttm -63.99 95.89 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.451 0.7 . . . . 74.510000000000005 112.649 -171.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -94.63 129.68 41.4 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.509 1.124 . . . . 71.040000000000006 110.38 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.491 1.578 0 C-N-CA 123.465 0.706 . . . . 75.329999999999998 111.898 -178.72 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.274 -0.269 . . . . 62.219999999999999 110.274 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -113.8 -43.91 3.23 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.12 0.568 . . . . 72.140000000000001 111.901 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 ptp -158.9 29.7 0.22 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.857 0.863 . . . . 61.340000000000003 112.659 -178.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -77.56 81.41 4.02 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.28 0.562 . . . . 61.32 110.304 174.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -75.04 -29.86 60.9 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.991 0.916 . . . . 73.019999999999996 112.643 -171.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -82.18 -0.12 43.53 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.152 0.581 . . . . 40.210000000000001 112.498 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 73.41 43.93 35.86 Favored Glycine 0 C--N 1.352 1.461 0 N-CA-C 114.719 0.647 . . . . 61.32 114.719 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -106.79 122.21 45.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.939 0.496 . . . . 71.209999999999994 110.408 169.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -62.67 -39.33 93.59 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.504 1.122 . . . . 72.540000000000006 112.224 -177.253 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 61.11 175.15 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.073 1.349 . . . . 75.219999999999999 113.032 -175.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.4 ttm105 -76.06 130.15 37.91 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.363 -0.606 . . . . 72.540000000000006 109.363 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -67.63 141.96 56.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.969 0.414 . . . . 74.340000000000003 111.47 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -89.04 131.13 35.35 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.857 0.863 . . . . 73.299999999999997 110.309 -170.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 36.1 m -68.37 118.22 11.16 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.224 0.61 . . . . 64.209999999999994 110.7 176.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -94.12 -67.95 0.83 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.061 0.545 . . . . 70.430000000000007 111.061 -176.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -110.14 161.4 15.6 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.149 0.58 . . . . 70.25 112.438 -172.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 52.530000000000001 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.230000000000004 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 64.340000000000003 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.519999999999996 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.219999999999999 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.099999999999994 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.485 HD23 HD21 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 64.040000000000006 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 70.510000000000005 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 74.549999999999997 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.515 HG21 HD13 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.420000000000002 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.109999999999999 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 14.4 mm100 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.140000000000001 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 64.439999999999998 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 71.519999999999996 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 73.239999999999995 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.540000000000006 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 73.340000000000003 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.310000000000002 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.530000000000001 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.319999999999993 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.239999999999995 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.120000000000005 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.540000000000006 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 72.439999999999998 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.515 HD13 HG21 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 73.439999999999998 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 62.039999999999999 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 71.329999999999998 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.439999999999998 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.040000000000006 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 64.120000000000005 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.150000000000006 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.140000000000001 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.530000000000001 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 62.25 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.329999999999998 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 72.150000000000006 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.400000000000006 112.251 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 71.140000000000001 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TRP . . . . . 0.409 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.239999999999995 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.519999999999996 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 63.130000000000003 111.429 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 63.5 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.099999999999994 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.230000000000004 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.08 -46.54 86.95 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 60.25 111.776 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.03 -24.47 37.86 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.816 0.446 . . . . 62.409999999999997 111.387 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -61.15 -32.55 72.27 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 123.828 0.851 . . . . 75.420000000000002 110.97 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -68.66 122.0 17.61 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.34 -0.846 . . . . 71.230000000000004 111.128 175.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp 64.14 -164.4 0.25 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.867 1.267 . . . . 61.439999999999998 112.508 -179.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 72.64 -59.57 0.56 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.617 1.167 . . . . 74.129999999999995 109.026 -160.473 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 51.64 -175.85 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 126.922 2.089 . . . . 62.100000000000001 115.124 162.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 67.97 151.34 0.08 Allowed 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.097 0.959 . . . . 71.420000000000002 112.325 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 75.54 -57.53 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.862 1.665 . . . . 73.420000000000002 112.44 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.09 72.55 0.56 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 122.839 0.256 . . . . 62.520000000000003 112.826 176.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -88.28 135.45 33.44 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.981 0.913 . . . . 74.010000000000005 111.282 -173.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 19.5 ptp -155.78 137.0 13.83 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 124.28 1.032 . . . . 73.019999999999996 109.819 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.8 91.12 5.29 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 108.96 -0.756 . . . . 62.149999999999999 108.96 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 . . . . . 0 CA--C 1.561 1.391 0 C-N-CA 123.184 0.594 . . . . 75.239999999999995 110.118 177.269 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.357 0.122 . . . . 74.329999999999998 110.81 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -150.87 134.99 16.8 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.183 0.593 . . . . 74.200000000000003 110.167 -176.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -67.94 125.48 26.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.159 0.583 . . . . 75.019999999999996 111.089 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.2 m 67.78 106.74 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 124.882 1.273 . . . . 71.549999999999997 113.349 174.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -119.36 115.44 24.13 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.559 0.744 . . . . 74.329999999999998 109.75 166.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -83.51 92.84 7.69 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.274 0.559 . . . . 74.430000000000007 110.039 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -149.74 -47.94 0.02 OUTLIER Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.439 -0.801 . . . . 72.400000000000006 111.941 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? 60.84 81.06 0.2 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.848 1.259 . . . . 64.200000000000003 111.114 174.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.13 22.17 10.77 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.462 0.705 . . . . 70.310000000000002 111.366 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -80.01 -25.95 40.04 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.631 0.773 . . . . 74.340000000000003 110.746 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 59.04 -94.51 0.05 OUTLIER 'General case' 0 CA--C 1.565 1.529 0 C-N-CA 124.761 1.224 . . . . 71.140000000000001 112.715 176.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 174.62 166.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.78 1.232 . . . . 62.329999999999998 108.92 -176.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? 62.76 2.8 1.02 Allowed 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.863 1.06 . . . . 73.329999999999998 113.863 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.9 p -75.93 110.2 10.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.958 0.503 . . . . 72.219999999999999 110.775 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.5 p -83.42 41.55 0.78 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.974 0.91 . . . . 73.010000000000005 110.892 175.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 -129.98 128.58 42.35 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.368 1.067 . . . . 74.439999999999998 109.699 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 70.439999999999998 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.420000000000002 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.209999999999994 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.229999999999997 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 71.129999999999995 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.109999999999999 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.556 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.439999999999998 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.631 HD23 HD21 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 70.299999999999997 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.230000000000004 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.556 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.219999999999999 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.209999999999994 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.310000000000002 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.510000000000005 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 64.0 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 55.43 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 65.340000000000003 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 64.319999999999993 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.340000000000003 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.540000000000006 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 70.510000000000005 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.430000000000007 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.329999999999998 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.109999999999999 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 55.130000000000003 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 62.32 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD21 HD23 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 73.299999999999997 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.439999999999998 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.349999999999994 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 74.329999999999998 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.239999999999995 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 64.409999999999997 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.230000000000004 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.239999999999995 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.450000000000003 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.510000000000005 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 54.100000000000001 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.549999999999997 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 54.119999999999997 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 72.120000000000005 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 73.430000000000007 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.439999999999998 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.329999999999998 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 64.439999999999998 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.24 -37.59 80.85 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.340000000000003 111.449 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 13.1 tmtt? -75.68 -41.62 53.29 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.553 0.741 . . . . 71.140000000000001 110.672 174.486 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 92.3 t90 -57.41 -43.15 83.54 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 124.51 1.124 . . . . 71.349999999999994 112.008 -175.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -71.41 -72.23 0.23 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.893 0.477 . . . . 72.430000000000007 110.591 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -169.97 115.1 0.52 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.766 0.826 . . . . 71.519999999999996 109.747 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.651 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 62.2 ttt180 -102.38 -50.1 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.442 0.697 . . . . 61.43 111.292 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -76.47 129.13 36.07 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.941 0.4 . . . . 71.239999999999995 111.213 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -128.99 137.82 51.58 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.044 0.938 . . . . 74.230000000000004 110.36 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -146.26 -175.37 4.74 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.671 0.789 . . . . 74.409999999999997 110.683 174.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 110.04 39.09 1.59 Allowed Glycine 0 N--CA 1.478 1.473 0 CA-C-O 121.185 0.325 . . . . 74.430000000000007 112.754 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -99.77 99.88 10.75 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.039 0.935 . . . . 64.310000000000002 109.305 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -147.62 -35.5 0.23 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.144 0.794 . . . . 74.219999999999999 113.144 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 63.57 119.05 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 124.514 1.126 . . . . 54.32 111.392 -174.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 CA--C 1.577 1.999 0 N-CA-C 113.948 1.092 . . . . 64.109999999999999 113.948 -170.463 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 110.539 -0.171 . . . . 41.450000000000003 110.539 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -163.06 103.46 0.99 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.761 0.824 . . . . 75.340000000000003 110.456 175.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.3 mtt -87.98 161.32 17.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.178 0.591 . . . . 63.32 110.432 171.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.8 m -74.81 148.49 40.25 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.733 0.413 . . . . 43.200000000000003 110.517 175.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -77.52 11.55 1.98 Allowed 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 112.786 0.662 . . . . 64.150000000000006 112.786 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -91.64 8.05 38.64 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.952 0.901 . . . . 72.129999999999995 111.265 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.1 117.87 11.09 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 113.628 0.211 . . . . 52.119999999999997 113.628 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.06 -175.29 5.69 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.897 0.879 . . . . 71.439999999999998 111.308 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -83.78 64.07 7.84 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 108.462 -0.94 . . . . 73.319999999999993 108.462 164.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -100.34 18.59 18.51 Favored 'General case' 0 CA--C 1.565 1.523 0 C-N-CA 123.748 0.819 . . . . 62.229999999999997 110.834 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 72.58 129.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.112 1.365 . . . . 61.420000000000002 112.893 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -77.13 162.23 27.61 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.353 0.661 . . . . 62.5 111.617 175.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 83.58 5.32 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.942 0.497 . . . . 74.120000000000005 110.258 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.3 m -94.88 35.95 1.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 122.247 1.023 . . . . 62.509999999999998 109.617 177.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 p -90.76 114.12 26.4 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.997 0.919 . . . . 65.150000000000006 111.212 -174.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 62.54 -169.75 0.18 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.435 1.094 . . . . 75.230000000000004 112.926 172.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.530000000000001 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 63.43 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 65.25 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.120000000000005 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.329999999999998 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 70.439999999999998 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.519999999999996 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.529 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.040000000000006 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.010000000000005 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.540000000000006 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.437 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.209999999999994 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.109999999999999 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.219999999999999 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 72.230000000000004 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.329999999999998 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.099999999999994 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 71.430000000000007 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.530000000000001 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.239999999999995 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.409999999999997 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 72.010000000000005 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.140000000000001 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.019999999999996 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 72.450000000000003 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.510000000000005 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.529 HD21 HD23 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 61.130000000000003 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 70.099999999999994 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 74.310000000000002 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 64.439999999999998 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.210000000000001 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 55.130000000000003 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 62.32 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.349999999999994 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 55.240000000000002 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.467 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.310000000000002 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.409999999999997 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 45.340000000000003 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 64.0 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 64.409999999999997 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 54.340000000000003 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 64.129999999999995 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 71.040000000000006 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 55.030000000000001 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 62.32 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.349999999999994 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.310000000000002 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.43 67.66 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 65.129999999999995 111.578 173.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.52 -51.14 68.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.605 0.762 . . . . 71.120000000000005 110.261 171.105 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -62.88 -35.82 81.26 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.96 0.904 . . . . 74.239999999999995 110.443 176.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -95.29 51.94 1.37 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.417 1.087 . . . . 73.5 111.551 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.4 ' HB3' ' HE2' ' A' ' 66' ' ' LYS . 35.1 ttpt 71.51 117.61 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 124.037 0.935 . . . . 74.150000000000006 113.225 167.727 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.33 -68.76 0.36 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.775 0.83 . . . . 75.200000000000003 112.016 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.37 116.01 19.35 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.169 0.588 . . . . 74.349999999999994 109.818 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -77.49 11.94 1.8 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.144 0.794 . . . . 65.230000000000004 113.144 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -71.71 141.9 49.82 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.399 0.68 . . . . 51.140000000000001 111.438 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 134.1 -96.22 0.28 Allowed Glycine 0 C--N 1.343 0.956 0 N-CA-C 110.813 -0.915 . . . . 53.140000000000001 110.813 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -63.18 -39.64 95.22 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.03 0.532 . . . . 73.310000000000002 110.266 172.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 ttt -91.86 124.98 36.39 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.469 0.707 . . . . 54.399999999999999 110.158 170.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.6 91.73 3.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.953 -0.758 . . . . 75.409999999999997 108.953 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.571 1.78 0 C-N-CA 123.279 0.631 . . . . 55.509999999999998 111.758 -175.757 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 111.549 0.203 . . . . 72.239999999999995 111.549 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.36 88.09 1.55 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.12 0.568 . . . . 75.109999999999999 110.889 -176.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtm -92.54 114.75 27.38 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.853 0.861 . . . . 74.329999999999998 110.076 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -66.43 -60.77 2.44 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.859 0.864 . . . . 61.340000000000003 112.281 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -90.3 97.27 11.09 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.913 0.485 . . . . 71.430000000000007 109.696 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -133.4 -19.56 2.15 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.806 0.842 . . . . 75.230000000000004 111.619 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.7 79.7 1.87 Allowed Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.185 0.421 . . . . 34.130000000000003 112.837 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -86.15 162.27 18.45 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.591 0.756 . . . . 73.049999999999997 111.4 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.82 89.95 1.51 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.181 0.592 . . . . 74.340000000000003 110.609 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -141.95 106.14 4.78 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.001 0.92 . . . . 75.340000000000003 110.621 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.461 ' HB3' ' HG3' ' A' ' 13' ' ' ARG . 4.8 mpt_? -81.39 -45.89 15.44 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.941 0.496 . . . . 75.5 110.213 172.264 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.21 36.08 25.48 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.098 0.959 . . . . 60.210000000000001 112.419 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' HG3' ' HB3' ' A' ' 11' ' ' ARG . 69.6 mtp180 -66.49 -23.24 66.22 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.697 0.799 . . . . 64.120000000000005 111.544 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 27.1 m 69.92 89.9 0.1 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.078 1.351 . . . . 72.109999999999999 111.734 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.8 p -82.47 -35.55 27.35 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.908 0.883 . . . . 73.519999999999996 111.092 175.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -71.52 119.43 15.66 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.294 0.638 . . . . 63.210000000000001 109.941 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.420000000000002 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 64.219999999999999 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.319999999999993 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.030000000000001 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.329999999999998 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.520000000000003 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 54.25 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 53.210000000000001 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 73.0 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.299999999999997 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 44.219999999999999 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 63.130000000000003 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.439999999999998 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 53.420000000000002 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.020000000000003 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 72.010000000000005 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.420000000000002 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.140000000000001 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.340000000000003 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 65.420000000000002 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.099999999999994 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 61.109999999999999 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.120000000000005 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.129999999999995 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 62.520000000000003 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.239999999999995 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 63.219999999999999 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 65.519999999999996 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.530000000000001 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.239999999999995 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 45.520000000000003 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 64.25 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 53.240000000000002 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.049999999999997 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.209999999999994 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 63.210000000000001 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.049999999999997 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 64.420000000000002 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 41.229999999999997 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 73.129999999999995 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.420000000000002 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 72.329999999999998 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.310000000000002 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 65.150000000000006 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.664 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 73.430000000000007 112.667 177.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.26 -53.61 55.6 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 72.030000000000001 111.154 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -73.45 -31.25 63.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.604 -0.726 . . . . 72.409999999999997 111.224 177.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.664 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.9 t90 -64.87 -29.97 70.95 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.827 0.851 . . . . 75.109999999999999 111.618 175.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -76.22 -11.73 59.97 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 112.951 0.722 . . . . 54.020000000000003 112.951 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt 76.18 -54.64 0.6 Allowed 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.33 1.052 . . . . 64.319999999999993 113.69 169.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -82.25 48.88 1.32 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.55 0.74 . . . . 72.450000000000003 112.269 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -79.31 80.43 5.67 Favored 'General case' 0 CA--C 1.56 1.333 0 O-C-N 121.817 -0.552 . . . . 75.010000000000005 109.695 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 178.52 -55.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 126.353 1.861 . . . . 74.439999999999998 108.862 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 68.58 -64.05 0.32 Allowed 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.449 1.499 . . . . 70.510000000000005 113.83 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.29 153.99 9.1 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.012 1.165 . . . . 71.400000000000006 116.012 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.09 172.49 11.61 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.412 1.085 . . . . 51.200000000000003 112.658 -172.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 mtt -66.03 93.94 0.22 Allowed 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 123.467 0.707 . . . . 74.129999999999995 110.845 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 111.08 10.98 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.646 0.378 . . . . 74.310000000000002 110.973 178.338 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 123.4 0.68 . . . . 62.329999999999998 111.95 -176.883 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.495 1.819 0 N-CA-C 110.391 -0.225 . . . . 55.149999999999999 110.391 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -58.33 135.83 57.26 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.412 0.685 . . . . 64.239999999999995 111.186 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.5 mtt 66.42 175.95 0.23 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.781 1.232 . . . . 51.439999999999998 111.791 -171.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 t 58.74 86.74 0.08 Allowed 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.41 1.084 . . . . 72.400000000000006 112.176 -176.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -85.29 170.54 12.7 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.783 0.66 . . . . 74.409999999999997 112.783 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -66.9 102.86 1.02 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.529 0.731 . . . . 64.239999999999995 111.066 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 154.37 25.47 Favored Glycine 0 N--CA 1.47 0.935 0 CA-C-N 116.081 -0.509 . . . . 75.219999999999999 112.617 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt 63.06 -178.91 0.15 Allowed 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.127 0.971 . . . . 71.540000000000006 112.341 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 3.4 mptp? -96.34 -83.14 0.38 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.734 0.414 . . . . 74.439999999999998 109.962 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 64.15 164.31 0.13 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.573 1.149 . . . . 63.329999999999998 113.229 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtp85 61.87 31.31 18.28 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 123.927 0.891 . . . . 54.450000000000003 113.289 170.021 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -118.17 165.22 14.06 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.541 0.736 . . . . 75.310000000000002 111.862 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 66.47 107.63 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.923 1.289 . . . . 72.409999999999997 112.414 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.7 p -75.22 107.11 7.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.157 0.583 . . . . 64.239999999999995 110.436 175.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.2 m -113.71 -75.4 0.6 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.17 0.588 . . . . 62.100000000000001 110.394 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -117.64 130.82 56.61 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.873 0.469 . . . . 54.240000000000002 110.26 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.140000000000001 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.209999999999994 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.340000000000003 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 33.140000000000001 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.530000000000001 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 61.0 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.329999999999998 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.506 HD23 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.400000000000006 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.209999999999994 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 55.130000000000003 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 71.209999999999994 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.409999999999997 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.109999999999999 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.430000000000007 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 53.140000000000001 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 72.150000000000006 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.430000000000007 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.120000000000005 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 71.230000000000004 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 71.25 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 44.009999999999998 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 41.509999999999998 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.140000000000001 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 70.239999999999995 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 54.229999999999997 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 71.150000000000006 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 61.109999999999999 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 73.519999999999996 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.150000000000006 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.540000000000006 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 63.539999999999999 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.040000000000006 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 45.229999999999997 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.120000000000005 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.420000000000002 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.530000000000001 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.450000000000003 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.239999999999995 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.219999999999999 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.099999999999994 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.109999999999999 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 73.439999999999998 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -57.6 9.39 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.530000000000001 110.461 171.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -53.59 -31.81 48.46 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 124.718 1.207 . . . . 64.409999999999997 113.07 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -80.73 -37.44 30.53 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.822 1.249 . . . . 75.120000000000005 111.753 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -84.04 -64.47 1.16 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.056 0.943 . . . . 51.509999999999998 111.23 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -148.27 124.94 11.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.511 1.124 . . . . 52.409999999999997 109.126 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -55.99 100.54 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.263 0.352 . . . . 73.209999999999994 110.3 178.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.63 134.33 56.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.241 1.016 . . . . 64.349999999999994 111.46 -172.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -135.58 102.52 5.14 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.271 0.628 . . . . 64.0 111.228 -175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -96.5 161.3 13.97 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 122.802 0.441 . . . . 72.439999999999998 110.392 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.14 -78.66 0.31 Allowed Glycine 0 N--CA 1.47 0.959 0 CA-C-N 116.376 -0.375 . . . . 74.019999999999996 112.267 -177.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.76 145.16 45.29 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.556 0.342 . . . . 70.150000000000006 110.439 173.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 tpt 60.33 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.907 1.283 . . . . 70.040000000000006 112.073 -170.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -108.93 118.57 37.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.487 0.715 . . . . 73.340000000000003 109.825 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 . . . . . 0 CA--C 1.57 1.737 0 C-N-CA 123.528 0.731 . . . . 74.439999999999998 112.151 179.971 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 120.412 0.148 . . . . 70.439999999999998 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -137.93 102.53 4.73 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.237 0.615 . . . . 64.349999999999994 109.346 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 ptm -145.42 175.57 10.23 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.965 0.506 . . . . 74.219999999999999 111.808 -175.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.2 m -72.23 103.19 3.28 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.078 0.551 . . . . 74.519999999999996 110.423 173.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -84.18 54.81 3.08 Favored 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 124.02 0.928 . . . . 74.340000000000003 110.406 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -139.73 -31.22 0.68 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.571 1.148 . . . . 73.209999999999994 110.483 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.51 33.27 2.07 Favored Glycine 0 C--N 1.359 1.811 0 N-CA-C 115.254 0.862 . . . . 73.439999999999998 115.254 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -110.1 -37.68 5.51 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.72 0.808 . . . . 63.219999999999999 110.413 174.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 58.93 78.34 0.26 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.252 1.021 . . . . 73.010000000000005 110.878 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.4 mtm-85 -85.15 170.09 13.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.414 -0.812 . . . . 74.310000000000002 111.218 -176.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HB3' ' HD2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -53.42 56.6 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 122.802 0.441 . . . . 73.540000000000006 111.165 176.675 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 56.18 17.89 2.98 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 114.307 1.225 . . . . 62.420000000000002 114.307 173.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.489 ' HD2' ' HB3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -84.83 -4.31 59.03 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.488 0.715 . . . . 73.230000000000004 112.062 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.5 m 79.56 119.27 0.05 Allowed 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.497 1.519 . . . . 75.510000000000005 112.406 -178.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.3 m -147.48 -56.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.901 1.28 . . . . 74.510000000000005 108.595 171.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -127.66 130.14 48.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.257 1.023 . . . . 70.409999999999997 108.955 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.310000000000002 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 52.43 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.049999999999997 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.420000000000002 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 72.340000000000003 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.109999999999999 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.420000000000002 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.499 HD23 HD21 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.150000000000006 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.230000000000004 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 70.430000000000007 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 63.32 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 64.230000000000004 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 11.7 mm100 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.120000000000005 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.140000000000001 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.140000000000001 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.319999999999993 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 74.439999999999998 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 71.530000000000001 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.209999999999994 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 73.549999999999997 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.409999999999997 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 51.130000000000003 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.010000000000005 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 64.329999999999998 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.349999999999994 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.499 HD21 HD23 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 71.099999999999994 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.349999999999994 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 61.439999999999998 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 63.020000000000003 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 70.239999999999995 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 54.039999999999999 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 64.140000000000001 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 52.140000000000001 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.030000000000001 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 42.119999999999997 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.543 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 55.119999999999997 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.435 HG13 HD23 ' A' ' 42' ' ' LEU . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 63.439999999999998 110.018 171.145 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.530000000000001 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.219999999999999 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 72.230000000000004 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.510000000000005 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.109999999999999 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 61.32 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.521 HH21 ' HG3' ' A' ' 63' ' ' LYS . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.439999999999998 110.995 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.575 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 54.32 111.527 172.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' HH21 ' A' ' 65' ' ' ARG . . . -64.54 -31.82 73.21 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 45.149999999999999 111.528 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG3' HH21 ' A' ' 60' ' ' ARG . 33.0 mmtm -83.3 -42.46 17.11 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.603 0.761 . . . . 65.040000000000006 111.835 171.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.575 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 68.7 t90 -56.89 -36.01 69.63 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.695 1.198 . . . . 75.230000000000004 112.383 -175.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.436 HH21 ' HA ' ' A' ' 62' ' ' ALA . 67.6 mtm180 -66.16 111.1 3.25 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 123.126 0.57 . . . . 74.430000000000007 111.062 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -70.98 131.78 44.19 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.665 0.786 . . . . 61.049999999999997 111.924 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ptt85 -142.9 108.92 5.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.15 0.58 . . . . 74.010000000000005 110.717 174.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 64.04 5.68 2.52 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.862 1.265 . . . . 74.409999999999997 113.946 173.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 56.43 31.13 18.25 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.294 1.038 . . . . 70.329999999999998 111.3 -170.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 61.27 34.97 18.38 Favored 'General case' 0 CA--C 1.565 1.544 0 C-N-CA 124.979 1.312 . . . . 64.209999999999994 112.076 -175.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.51 -140.55 15.11 Favored Glycine 0 C--N 1.353 1.484 0 CA-C-N 115.836 -0.62 . . . . 62.130000000000003 113.4 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 61.08 55.0 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.719 1.208 . . . . 53.240000000000002 111.616 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.4 mmt -81.89 99.23 8.93 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.217 -0.901 . . . . 72.010000000000005 111.43 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -118.64 -74.19 0.62 Allowed 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.683 0.793 . . . . 64.329999999999998 111.011 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 . . . . . 0 CA--C 1.571 1.751 0 C-N-CA 122.935 0.494 . . . . 75.099999999999994 111.282 176.156 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 110.595 -0.15 . . . . 73.310000000000002 110.595 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -83.24 49.26 1.52 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 113.267 0.84 . . . . 61.32 113.267 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -114.47 -47.85 2.9 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.877 0.871 . . . . 75.549999999999997 110.231 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.8 m 58.92 32.53 22.34 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.392 1.077 . . . . 73.439999999999998 111.837 -175.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.58 73.88 0.35 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.456 1.502 . . . . 43.32 111.974 -172.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt 55.52 -82.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.217 1.407 . . . . 75.420000000000002 114.028 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.98 -139.9 17.34 Favored Glycine 0 C--N 1.35 1.345 0 N-CA-C 111.293 -0.723 . . . . 53.240000000000002 111.293 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt 59.2 25.0 13.47 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 124.593 1.157 . . . . 75.239999999999995 112.548 174.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -72.02 83.6 0.97 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.816 -0.809 . . . . 73.040000000000006 108.816 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -85.72 42.52 0.97 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.262 0.625 . . . . 63.310000000000002 112.456 -171.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -73.52 89.6 1.7 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-O 121.907 0.86 . . . . 74.099999999999994 109.824 171.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -154.09 168.12 27.53 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.927 1.291 . . . . 73.140000000000001 109.258 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.417 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -83.1 153.51 24.82 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.302 -0.629 . . . . 64.120000000000005 109.302 173.124 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 m -63.28 95.92 0.1 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.951 0.405 . . . . 73.530000000000001 110.44 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.0 p -94.85 -40.18 9.86 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.03 0.932 . . . . 73.230000000000004 110.935 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -140.18 157.72 45.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.118 0.967 . . . . 75.040000000000006 110.329 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 73.219999999999999 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.219999999999999 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 73.430000000000007 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.400000000000006 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 40.219999999999999 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.129999999999995 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 53.409999999999997 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 70.019999999999996 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 54.100000000000001 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.424 ' NZ ' ' HB2' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 70.239999999999995 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.430000000000007 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.109999999999999 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.120000000000005 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 73.239999999999995 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.319999999999993 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . 0.421 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.319999999999993 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.420000000000002 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.439999999999998 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 53.009999999999998 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.239999999999995 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.319999999999993 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.697 HH11 HG12 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.299999999999997 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.519999999999996 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 52.229999999999997 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 72.430000000000007 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.010000000000005 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.140000000000001 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 63.43 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 64.239999999999995 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.340000000000003 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 74.209999999999994 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.129999999999995 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 63.299999999999997 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 51.140000000000001 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.510000000000005 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.697 HG12 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.209999999999994 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 70.25 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 73.519999999999996 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 72.239999999999995 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.340000000000003 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 70.0 111.15 175.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 65.310000000000002 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.349999999999994 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 74.049999999999997 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.49 -45.29 76.29 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.329999999999998 109.993 167.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -67.91 -31.56 71.42 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 124.732 1.213 . . . . 55.149999999999999 111.747 175.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.0 t90 -64.7 -21.29 66.71 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.991 1.316 . . . . 72.150000000000006 112.289 177.029 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 61' ' ' ARG . 80.0 mtt180 -80.8 -23.69 39.07 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.278 0.631 . . . . 73.109999999999999 112.604 177.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.2 mptt 51.53 98.67 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.866 1.267 . . . . 74.040000000000006 113.041 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -82.8 148.62 27.68 Favored 'General case' 0 CA--C 1.559 1.299 0 O-C-N 122.019 -0.425 . . . . 74.409999999999997 110.021 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 69.05 44.65 0.99 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.894 1.278 . . . . 73.299999999999997 111.855 -174.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -62.19 -48.58 79.39 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.617 0.767 . . . . 72.150000000000006 110.89 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -82.24 164.56 21.1 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.252 -0.885 . . . . 75.25 111.049 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.79 169.55 45.99 Favored Glycine 0 CA--C 1.534 1.259 0 CA-C-N 116.272 -0.422 . . . . 74.040000000000006 113.917 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -83.6 160.37 21.42 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 74.409999999999997 110.728 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 80.7 mtp -70.56 158.83 35.44 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.841 0.353 . . . . 73.099999999999994 111.012 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -71.75 134.6 46.32 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.102 0.561 . . . . 61.340000000000003 112.0 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 . . . . . 0 C--O 1.258 1.512 0 C-N-CA 123.46 0.704 . . . . 72.430000000000007 110.163 178.661 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 120.607 0.242 . . . . 61.530000000000001 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -132.15 135.18 46.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.806 0.842 . . . . 75.519999999999996 110.602 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.3 mtm -96.6 160.97 14.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.559 0.743 . . . . 52.450000000000003 110.612 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.6 p -76.35 77.03 3.11 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 112.571 0.582 . . . . 74.310000000000002 112.571 -174.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.6 t30 61.67 172.08 0.12 Allowed 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.639 1.175 . . . . 75.030000000000001 112.685 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -106.64 95.07 5.48 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.858 0.837 . . . . 73.129999999999995 110.377 172.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 90.47 1.31 Allowed Glycine 0 CA--C 1.533 1.207 0 CA-C-N 115.56 -0.745 . . . . 53.140000000000001 113.377 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -97.4 16.21 20.79 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.142 0.577 . . . . 62.310000000000002 111.55 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -64.0 111.12 2.37 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.824 0.85 . . . . 72.430000000000007 112.197 -174.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -88.66 152.28 21.92 Favored 'General case' 0 CA--C 1.561 1.404 0 C-N-CA 123.592 0.757 . . . . 71.349999999999994 111.596 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? 63.42 101.64 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.165 1.386 . . . . 61.329999999999998 113.349 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -98.93 13.05 34.0 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.693 0.797 . . . . 60.409999999999997 111.751 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -67.13 99.35 0.66 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.223 0.609 . . . . 52.219999999999999 112.305 -174.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.5 t -138.08 26.91 2.67 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.947 0.899 . . . . 73.329999999999998 110.247 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.0 p -76.17 -53.17 8.67 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.461 0.704 . . . . 71.219999999999999 111.587 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 63.26 174.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.898 1.279 . . . . 70.329999999999998 112.903 -176.618 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.230000000000004 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.519999999999996 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.219999999999999 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.109999999999999 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 70.319999999999993 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.310000000000002 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.040000000000006 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.310000000000002 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.510000000000005 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.510000000000005 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 64.530000000000001 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.310000000000002 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 63.130000000000003 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.239999999999995 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.230000000000004 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 65.409999999999997 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.200000000000003 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.200000000000003 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . 0.435 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 73.129999999999995 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.120000000000005 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.530000000000001 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 40.210000000000001 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.299999999999997 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.310000000000002 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 73.219999999999999 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.340000000000003 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.130000000000003 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.340000000000003 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.299999999999997 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 53.229999999999997 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 70.209999999999994 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 61.32 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 70.409999999999997 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.140000000000001 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 50.229999999999997 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.319999999999993 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 73.430000000000007 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.120000000000005 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.319999999999993 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 73.510000000000005 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.329999999999998 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.319999999999993 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.530000000000001 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 64.430000000000007 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 72.150000000000006 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.39 -27.65 62.5 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.530000000000001 111.605 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -27.01 32.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.821 0.449 . . . . 63.039999999999999 110.959 171.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -77.23 -39.68 47.6 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.493 0.717 . . . . 65.420000000000002 111.477 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.47 ' NH2' ' HB2' ' A' ' 68' ' ' GLU . 34.3 ttt180 -125.22 142.52 51.45 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.002 0.521 . . . . 73.239999999999995 111.482 -176.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -137.75 -37.8 0.59 Allowed 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.923 0.712 . . . . 55.310000000000002 112.923 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -58.93 -73.24 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 113.755 1.02 . . . . 74.109999999999999 113.755 -170.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.47 ' HB2' ' NH2' ' A' ' 65' ' ' ARG . 3.6 mp0 -99.98 161.0 13.88 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 118.465 0.575 . . . . 60.219999999999999 111.238 175.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -89.78 -34.49 16.15 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.844 0.457 . . . . 71.400000000000006 111.005 173.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.2 t80 55.15 92.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.948 1.299 . . . . 74.549999999999997 112.338 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -165.37 -175.69 36.22 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 116.43 -0.35 . . . . 73.239999999999995 113.398 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -47.59 49.28 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.266 0.626 . . . . 61.43 110.139 177.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 15.7 tpt -149.22 -78.26 0.14 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.791 0.436 . . . . 75.230000000000004 110.277 174.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -172.82 137.01 0.73 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.871 0.868 . . . . 74.510000000000005 109.969 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.489 1.484 0 C-N-CA 123.252 0.621 . . . . 71.299999999999997 111.643 177.521 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 . . . . . 0 CA--C 1.555 1.154 0 CA-C-O 120.805 0.336 . . . . 73.24 111.248 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 51.21 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 62.41 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.34 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 72.14 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 74.54 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.14 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.01 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.613 HD23 HD21 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.32 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 61.44 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.53 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.14 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 74.24 111.204 172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 65.42 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.14 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 71.32 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 60.13 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.42 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.53 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 64.05 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 73.34 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 73.34 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 65.43 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.15 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.613 HD21 HD23 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 73.21 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 52.43 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.11 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.31 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 62.41 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.11 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.44 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 52.31 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.31 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.31 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.52 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 55.34 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 54.23 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 65.01 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.34 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.21 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.23 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.52 110.29 177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 71.41 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 72.35 111.801 176.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 63.31 111.167 177.165 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.399 0.618 . . . . 43.33 111.983 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.11 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 71.43 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.1 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.15 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 64.04 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.22 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.54 HD23 HD21 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.13 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.34 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 72.53 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 72.53 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 44.4 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 72.42 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 72.32 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 63.12 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.45 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 72.13 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.11 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.445 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.21 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 53.12 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 73.13 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.41 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.41 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.34 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.54 HD21 HD23 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 61.33 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.53 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 62.21 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 72.52 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.24 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.03 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.34 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.21 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.21 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.44 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 71.42 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.11 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.14 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.24 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.14 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 71.21 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 61.51 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.22 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 73.32 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 51.14 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.24 110.801 175.407 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.005 0.431 . . . . 64.03 111.775 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 45.41 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 63.42 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.34 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 63.33 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.31 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.41 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 71.31 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.21 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.01 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.14 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.24 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.34 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.0 mm-40 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.33 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.21 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.24 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.22 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.53 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.14 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.3 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.42 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 71.23 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 41.44 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 72.12 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 72.22 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 64.23 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 52.22 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.42 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.52 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 70.44 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.33 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.01 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.1 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.2 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.52 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.1 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 72.35 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.23 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 73.24 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.435 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 63.44 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.409 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.34 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 73.41 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 60.33 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 70.5 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.33 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 51.54 111.721 -178.165 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.079 0.466 . . . . 74.51 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.52 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 51.42 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.15 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.44 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.34 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.32 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 64.12 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.674 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.44 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.51 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 62.03 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 53.03 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 73.35 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 55.21 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 72.35 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.774 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.43 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.15 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.4 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.22 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 73.42 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 71.12 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 72.51 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 55.15 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.32 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.32 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.674 HD21 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.43 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.03 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 72.52 112.628 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 71.32 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 62.01 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 44.13 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.23 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.31 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.22 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 73.4 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.42 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.24 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.43 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 62.4 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.23 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.3 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 54.23 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 42.52 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.33 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.774 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.02 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.32 110.59 172.542 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 110.01 -0.367 . . . . 64.01 110.01 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.24 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.22 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 55.34 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.02 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 62.44 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.22 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 73.54 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.05 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 51.44 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 70.21 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 61.14 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.41 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.42 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 74.34 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.15 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 72.51 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 32.32 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 61.23 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 65.3 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.31 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.2 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 64.01 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 71.31 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 29.1 mm-40 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 64.05 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.42 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.31 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.42 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.53 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.34 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.41 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.13 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 70.03 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.21 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.405 ' HA ' HE21 ' A' ' 54' ' ' GLN . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 65.2 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 65.43 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 51' ' ' ALA . 46.3 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.35 110.663 172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 40.34 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.13 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.11 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 72.32 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.24 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.51 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 73.25 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.01 111.794 -177.915 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 . . . . . 0 N--CA 1.492 1.635 0 N-CA-C 111.364 0.135 . . . . 74.34 111.364 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.12 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.12 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.54 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 64.44 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 71.54 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.41 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.458 HD23 HD21 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 62.3 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.21 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 61.33 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.4 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.12 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.24 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 64.42 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 61.44 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 71.11 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.2 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.03 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 63.24 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 62.54 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 53.13 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.21 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.43 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 65.34 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.458 HD21 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 72.34 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.15 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 53.45 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.31 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 72.03 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 65.51 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 54.54 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 73.12 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.22 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 53.01 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.43 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 45.25 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 64.54 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 53.52 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 72.33 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.606 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 72.22 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.41 HE21 ' NH2' ' A' ' 61' ' ' ARG . 30.4 mm-40 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.15 110.933 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.43 110.225 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.1 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.606 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.31 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 64.01 111.134 172.303 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 . . . . . 0 CA--C 1.55 0.957 0 N-CA-C 108.509 -0.923 . . . . 71.41 108.509 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 54.25 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.31 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.22 111.14 -178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 52.45 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.24 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 54.55 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' GLN . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.33 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 71.24 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 64.12 110.926 173.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 65.42 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 65.33 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.23 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 63.54 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.13 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 64.54 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.1 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.22 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.12 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 71.43 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 61.13 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.749 HH11 HG12 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 72.31 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.42 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 65.32 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 63.14 112.264 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 53.43 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.45 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.33 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.43 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 74.14 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.24 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 70.11 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.441 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 72.22 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 52.22 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 74.01 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.749 HG12 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 64.31 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 64.13 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.53 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.33 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 71.31 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.02 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 72.22 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 73.01 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.4 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.54 111.317 173.491 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 . . . . . 0 CA--C 1.552 1.035 0 CA-C-O 120.537 0.208 . . . . 75.34 110.913 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.41 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.34 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.51 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 73.14 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 64.11 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.02 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 71.32 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 72.41 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 61.45 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.22 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.23 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 50.34 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.41 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.34 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 53.34 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 52.15 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.33 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.51 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.55 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 63.14 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.13 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.4 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 64.53 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 43.4 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 74.45 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.489 HD21 HD23 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.51 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 65.13 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.23 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 72.13 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.45 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.42 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 60.15 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 72.33 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 73.35 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.2 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.21 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.475 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 64.31 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 71.42 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 71.32 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.4 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.31 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.31 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.32 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.4 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 72.54 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 65.01 110.696 175.619 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.289 0.566 . . . . 70.31 112.235 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 53.25 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 63.42 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.44 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.53 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.43 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.34 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.42 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 65.01 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 61.44 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.15 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 71.02 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 72.05 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 62.42 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 64.54 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 71.34 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.464 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.43 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.33 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.41 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 71.53 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.23 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 72.51 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.21 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 71.22 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.02 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 44.41 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.01 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.35 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 72.44 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.43 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.45 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 74.11 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 70.22 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 34.53 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.42 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 62.3 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.34 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 60.1 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.45 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 74.32 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 54.23 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.53 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.43 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 63.54 111.34 176.107 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 . . . . . 0 N--CA 1.495 1.781 0 N-CA-C 112.899 0.703 . . . . 60.43 112.899 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 63.53 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 44.22 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.41 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.51 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 71.54 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.15 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.1 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.539 HD23 HD21 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 70.44 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.15 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 62.33 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.35 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.44 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.21 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 64.2 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.42 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.41 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.41 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 64.45 113.739 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.02 112.512 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.54 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 71.2 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 51.22 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.418 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 63.34 111.231 176.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.41 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 65.42 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.539 HD21 HD23 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.14 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 60.12 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 71.24 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 60.42 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.624 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 41.43 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 74.33 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.12 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.41 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.23 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.41 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HD3' HD22 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 54.41 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 63.54 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.43 112.468 177.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.14 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 72.3 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 71.2 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.433 HE22 ' NH2' ' A' ' 61' ' ' ARG . 26.5 mm-40 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.23 109.951 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.42 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 62.21 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.433 ' NH2' HE22 ' A' ' 58' ' ' GLN . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.41 111.875 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 32.44 110.559 172.064 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 111.529 0.196 . . . . 75.43 111.529 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 62.14 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 53.53 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 71.3 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.643 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 70.04 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.33 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.14 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 63.12 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 63.42 111.128 176.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.12 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 63.34 111.816 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.33 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 73.55 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.35 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.02 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.03 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 62.5 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 72.51 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.13 112.924 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.52 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 62.5 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.31 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.13 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 73.14 111.385 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.31 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 62.43 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 62.35 110.964 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 63.3 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 53.54 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.12 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.643 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 64.55 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.34 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.424 ' HG ' HE21 ' A' ' 20' ' ' GLN . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 71.41 112.079 -178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 60.23 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.43 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.42 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.42 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 65.2 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.42 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 55.42 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.12 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.31 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.15 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 63.44 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.05 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 74.14 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 74.4 111.491 175.58 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 . . . . . 0 N--CA 1.481 1.101 0 N-CA-C 111.238 0.088 . . . . 61.34 111.238 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 61.13 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 62.21 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.11 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.15 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 63.24 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.14 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 62.41 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.584 HD23 HD21 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.33 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 63.43 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.42 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 53.14 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 63.23 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.11 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.01 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.22 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 71.44 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.32 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.689 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.31 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.32 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 73.14 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.11 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 73.15 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.51 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 71.04 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 71.45 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.584 HD21 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 61.15 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 63.21 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.41 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 73.1 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.556 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 63.23 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.12 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.14 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 61.23 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 72.54 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.31 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.658 ' HG2' HD22 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.21 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.04 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.54 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 72.21 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.03 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.04 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.41 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 61.44 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.54 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.689 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.32 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 54.05 111.518 177.482 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 112.438 0.533 . . . . 70.25 112.438 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 52.53 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.23 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 64.34 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.52 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.22 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.1 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.485 HD23 HD21 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 64.04 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 70.51 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 74.55 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.515 HG21 HD13 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.42 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.11 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 72.0 mm-40 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.14 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 64.44 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 71.52 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 73.24 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.54 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 73.34 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.31 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.53 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.32 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.24 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.12 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.54 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 72.44 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.515 HD13 HG21 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 73.44 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 62.04 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 71.33 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.44 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.04 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 64.12 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.15 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.14 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.53 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 62.25 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.33 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 72.15 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.4 112.251 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 71.14 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . 0.409 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.24 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.52 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 63.13 111.429 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 63.5 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.1 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.23 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 60.25 111.776 178.424 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 . . . . . 0 CA--C 1.548 0.879 0 N-CA-C 109.699 -0.482 . . . . 74.44 109.699 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 70.44 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.42 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.21 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.23 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 71.13 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.11 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.556 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.44 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.631 HD23 HD21 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 70.3 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.23 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.556 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.22 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.21 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.31 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.51 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 64.0 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 55.43 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 65.34 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 64.32 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.34 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.54 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 70.51 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.43 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.33 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.11 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 55.13 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 62.32 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD21 HD23 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 73.3 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.44 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.35 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 74.33 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.24 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 64.41 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.23 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.24 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.45 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.51 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 54.1 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.55 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 54.12 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 72.12 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 73.43 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.44 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.33 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 64.44 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.34 111.449 177.376 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 . . . . . 0 N--CA 1.488 1.467 0 N-CA-C 112.926 0.713 . . . . 75.23 112.926 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.53 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 63.43 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 65.25 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.12 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.33 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 70.44 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.52 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.529 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.04 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.01 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.54 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.437 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.21 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.11 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.22 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 72.23 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.33 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.1 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 71.43 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.53 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.24 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.41 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 72.01 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.14 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.02 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 72.45 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.51 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.529 HD21 HD23 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 61.13 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 70.1 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 74.31 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 64.44 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.21 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 55.13 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 62.32 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.35 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 55.24 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.467 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.31 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.41 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 45.34 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 64.41 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 54.34 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 64.13 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 71.04 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 55.03 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 62.32 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.35 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.31 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 65.13 111.578 173.349 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 109.941 -0.392 . . . . 63.21 109.941 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.42 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 64.22 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.32 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.03 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.33 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.52 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 54.25 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 53.21 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 73.0 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.3 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 44.22 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 63.13 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.44 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 53.42 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.02 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 72.01 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.42 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.14 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.34 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 65.42 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.1 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 61.11 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.12 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.13 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 62.52 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.24 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 63.22 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 65.52 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.53 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.24 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 45.52 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 64.25 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 53.24 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.05 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.21 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 63.21 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.05 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 64.42 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 41.23 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 73.13 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.42 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 72.33 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.31 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 65.15 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 73.43 112.667 177.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 72.03 111.154 176.115 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 110.26 -0.274 . . . . 54.24 110.26 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.14 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.21 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.34 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 33.14 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.53 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 61.0 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.33 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.506 HD23 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.4 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.21 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 55.13 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 71.21 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.41 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.11 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.43 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 53.14 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 72.15 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.43 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.12 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 71.23 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 71.25 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 44.01 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 41.51 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.14 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 70.24 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 54.23 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 71.15 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 61.11 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 73.52 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.15 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.11 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.54 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 63.54 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.04 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 45.23 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.12 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.42 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.53 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.45 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.24 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.22 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.1 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.11 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 73.44 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.53 110.461 171.208 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 . . . . . 0 N--CA 1.482 1.135 0 N-CA-C 108.955 -0.757 . . . . 70.41 108.955 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.31 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 52.43 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.05 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.42 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 72.34 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.11 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.42 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.499 HD23 HD21 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.15 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.23 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 70.43 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 63.32 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 64.23 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 79.3 mm-40 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.12 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.14 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.14 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.32 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 74.44 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 71.53 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.21 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 73.55 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.41 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 51.13 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.01 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 64.33 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.35 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.499 HD21 HD23 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 71.1 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.35 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 61.44 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 63.02 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 70.24 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 54.04 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 64.14 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 52.14 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.03 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 42.12 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.543 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 55.12 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.435 HG13 HD23 ' A' ' 42' ' ' LEU . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 63.44 110.018 171.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.53 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.22 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 72.23 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.51 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.11 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 61.32 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.44 110.995 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 54.32 111.527 172.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 45.15 111.528 172.366 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.487 1.405 0 N-CA-C 110.329 -0.248 . . . . 75.04 110.329 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 73.22 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.22 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 73.43 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.4 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 40.22 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.13 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 53.41 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 70.02 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 54.1 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.424 ' NZ ' ' HB2' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 70.24 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.43 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.11 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.12 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 73.24 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.32 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . 0.421 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.32 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.42 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.44 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 53.01 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.24 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.32 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.697 HH11 HG12 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.3 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.52 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 52.23 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 72.43 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.01 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.14 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 63.43 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 64.24 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.34 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 74.21 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.13 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 63.3 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 51.14 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.51 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.697 HG12 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.21 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 70.25 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 73.52 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 72.24 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.34 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.475 ' NE2' HH21 ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 70.0 111.15 175.099 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 65.31 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.35 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . 0.475 HH21 ' NE2' ' A' ' 58' ' ' GLN . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 74.05 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.33 109.993 167.71 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 . . . . . 0 N--CA 1.493 1.688 0 N-CA-C 112.903 0.705 . . . . 70.33 112.903 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.23 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.52 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.22 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.11 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 70.32 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.31 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.04 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.31 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.51 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.51 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 64.53 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.31 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 63.13 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.24 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.23 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 65.41 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.2 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.2 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . 0.435 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 73.13 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.12 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.53 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 40.21 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.3 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.31 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 73.22 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.34 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.13 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.34 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.3 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 53.23 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 70.21 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 61.32 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 70.41 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.14 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 50.23 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.32 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 73.43 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.12 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.32 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 73.51 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.33 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.32 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.53 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 64.43 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 72.15 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.53 111.605 173.758 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 110.189 -0.3 . . . . 74.45 110.189 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -153.41 88.84 1.31 Allowed 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.5 0.72 . . . . 74.13 109.726 -177.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.5 mtt 56.99 34.91 25.69 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 124.9 1.28 . . . . 72.51 111.259 -174.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 18.7 m -86.69 179.45 6.78 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.487 1.115 . . . . 63.02 112.132 -174.526 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 12.2 m120 60.58 41.45 15.44 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.469 1.508 . . . . 71.54 112.807 172.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -84.36 -4.92 59.18 Favored 'General case' 0 N--CA 1.486 1.331 0 CA-C-N 115.426 -0.806 . . . . 74.54 112.099 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -75.41 98.25 1.12 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.023 -0.431 . . . . 21.52 112.023 173.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -66.37 107.21 1.94 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.683 0.793 . . . . 72.4 111.743 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 9.6 mtpm? -80.65 114.67 19.7 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.244 0.617 . . . . 61.52 111.594 178.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.552 ' HE ' ' HA ' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -86.38 -25.8 25.13 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.599 0.76 . . . . 72.41 110.827 170.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 48.8 mtp180 -76.45 97.7 4.37 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.459 0.703 . . . . 70.54 111.011 176.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 61.6 t30 67.41 130.73 0.02 OUTLIER 'General case' 0 CA--C 1.564 1.496 0 C-N-CA 125.413 1.485 . . . . 74.55 113.537 172.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 41.6 ttm180 -67.05 -68.04 0.41 Allowed 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.99 0.916 . . . . 61.21 110.824 177.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.1 m -109.9 118.38 36.32 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.448 0.699 . . . . 43.33 109.387 179.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.1 m -57.12 -30.3 64.28 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 124.241 1.016 . . . . 51.52 111.827 179.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -106.17 167.24 9.95 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 124.015 0.926 . . . . 73.24 111.248 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.9 t -122.68 178.15 5.14 Favored 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 123.349 0.659 . . . . 51.21 110.382 173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 33.6 m -53.58 -53.98 44.01 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.304 1.042 . . . . 62.41 112.5 -177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -61.0 -42.39 98.34 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 123.091 0.557 . . . . 72.34 111.994 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -60.65 -47.72 84.99 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.599 0.359 . . . . 72.14 110.601 178.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 81.3 mt -68.45 -25.58 65.07 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.033 0.533 . . . . 74.54 112.316 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -60.29 -57.3 13.36 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 122.619 0.368 . . . . 74.14 110.22 170.461 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -63.76 -45.13 91.22 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.822 0.849 . . . . 74.01 112.302 -177.123 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.613 HD23 HD21 ' A' ' 42' ' ' LEU . 73.2 mt -59.37 -49.19 78.77 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.097 0.959 . . . . 71.32 111.654 179.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 63.4 mm-40 -64.73 -40.7 95.76 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.07 0.548 . . . . 61.44 112.122 177.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -60.73 -42.3 97.04 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 122.528 0.331 . . . . 75.0 111.882 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.8 t -65.92 -43.05 93.05 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.053 0 C-N-CA 122.668 0.387 . . . . 63.43 110.508 173.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -63.1 -38.68 92.13 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 124.294 1.038 . . . . 74.53 113.069 -178.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.414 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.7 mm-40 -83.08 -23.76 32.97 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.246 0.618 . . . . 73.14 111.621 -176.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 8.9 mtpm? -85.86 -30.56 22.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 122.954 0.502 . . . . 74.24 111.204 172.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.9 t -159.93 122.59 3.42 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.314 1.046 . . . . 65.42 110.74 175.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -73.79 -7.75 53.39 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.712 -0.617 . . . . 54.14 111.908 178.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 9.5 p90 -127.62 94.58 37.39 Favored Pre-proline 0 CA--C 1.565 1.522 0 C-N-CA 124.517 1.127 . . . . 71.32 111.031 -178.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -77.8 122.62 5.95 Favored 'Trans proline' 0 CA--C 1.562 1.909 0 C-N-CA 122.286 1.991 . . . . 60.13 111.925 173.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.426 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.0 p-10 -70.46 172.89 7.67 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.186 0.594 . . . . 63.42 111.412 177.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 13.2 p -53.79 -39.06 37.66 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 123.429 0.692 . . . . 73.53 112.839 -175.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -73.32 -42.05 62.8 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.316 0.647 . . . . 64.05 110.352 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.64 -29.95 71.13 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.454 0.702 . . . . 73.34 111.994 176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.553 ' HB3' ' HG2' ' A' ' 50' ' ' GLU . 14.1 mmt180 -62.51 -47.65 83.01 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.799 0.84 . . . . 73.34 110.665 174.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -67.53 -46.08 73.82 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 124.045 0.938 . . . . 65.43 111.734 -177.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.6 mm-40 -61.14 -42.83 99.26 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.579 0.752 . . . . 74.15 111.294 178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.613 HD21 HD23 ' A' ' 24' ' ' LEU . 37.1 tp -66.86 -39.41 87.56 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.871 -0.604 . . . . 73.21 111.137 176.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.86 -52.3 65.63 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 123.953 0.901 . . . . 52.43 112.668 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 27.0 ptm -62.05 -33.54 74.57 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 123.176 0.59 . . . . 65.11 112.384 -179.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 -75.74 -40.23 55.85 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.358 0.663 . . . . 72.31 111.758 179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.3 p -85.34 -11.18 55.23 Favored 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 113.109 0.781 . . . . 62.41 113.109 -176.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 t70 71.42 9.49 6.48 Favored 'General case' 0 CA--C 1.576 1.945 0 C-N-CA 123.624 0.769 . . . . 74.11 111.368 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 63.2 mt -97.96 159.38 14.97 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.21 1.004 . . . . 73.44 110.229 177.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 80.7 p -87.87 168.26 13.05 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 120.807 0.337 . . . . 52.31 110.755 171.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.553 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 1.5 tm-20 -59.3 -35.63 74.12 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.687 0.795 . . . . 61.31 110.194 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.42 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -55.59 -41.45 73.42 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.028 0.931 . . . . 71.31 112.268 175.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -74.74 -30.25 61.44 Favored 'General case' 0 N--CA 1.493 1.719 0 C-N-CA 123.231 0.613 . . . . 75.52 111.163 179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 55.5 t -68.45 -34.24 64.56 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.462 0 C-N-CA 123.423 0.689 . . . . 55.34 110.498 173.146 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.414 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 96.2 mt-30 -62.53 -54.25 42.6 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.06 0.544 . . . . 54.23 110.463 173.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -57.8 -43.96 85.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.317 0 C-N-CA 123.312 0.645 . . . . 65.01 111.72 -176.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 65.2 t90 -63.97 -58.49 6.58 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 123.3 0.375 . . . . 72.34 110.791 -179.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -63.64 -38.36 90.83 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 113.546 0.943 . . . . 71.21 113.546 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -68.69 -38.32 80.24 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 118.5 0.591 . . . . 75.23 111.41 179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.415 ' OD1' ' HE2' ' A' ' 63' ' ' LYS . 32.5 t-20 -72.78 -39.15 66.97 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-O 121.13 0.49 . . . . 74.52 110.29 177.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 tpt85 -69.3 -44.02 72.62 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.566 1.146 . . . . 71.41 111.65 -175.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.511 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 35.5 mtp180 -67.43 -24.54 65.65 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.436 0.694 . . . . 72.35 111.801 176.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.73 -44.92 88.61 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.125 0.57 . . . . 63.31 111.167 177.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HE2' ' OD1' ' A' ' 59' ' ' ASN . 3.7 mptp? -65.4 -42.98 92.04 Favored 'General case' 0 N--CA 1.495 1.812 0 CA-C-O 121.084 0.469 . . . . 71.53 110.647 172.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.511 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.5 t90 -60.39 -26.25 66.51 Favored 'General case' 0 CA--C 1.562 1.438 0 C-N-CA 124.962 1.305 . . . . 72.42 112.109 -179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 19.4 mmt180 -61.74 -36.72 81.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.574 0.75 . . . . 74.23 112.91 176.023 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -78.08 89.96 4.22 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.099 0.476 . . . . 70.21 111.325 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 26.6 ptt180 -72.49 105.31 4.12 Favored 'General case' 0 CA--C 1.557 1.216 0 CA-C-N 115.635 -0.711 . . . . 74.41 109.728 171.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.447 ' HG3' ' HB2' ' A' ' 70' ' ' PHE . 9.8 tp10 -86.14 -50.62 6.86 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 116.201 -0.454 . . . . 64.53 112.19 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 61.44 43.62 10.22 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 122.408 1.099 . . . . 70.44 110.501 -175.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.447 ' HB2' ' HG3' ' A' ' 68' ' ' GLU . 34.2 t80 -76.06 -36.64 58.92 Favored 'General case' 0 N--CA 1.478 0.967 0 CA-C-N 115.114 -0.948 . . . . 64.21 112.308 -175.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -169.37 -173.38 36.92 Favored Glycine 0 C--N 1.348 1.217 0 N-CA-C 114.254 0.462 . . . . 72.34 114.254 -179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -78.12 -18.07 56.11 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.922 0.889 . . . . 60.22 112.786 -174.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 57.8 ttm -89.99 86.15 6.52 Favored 'General case' 0 N--CA 1.481 1.093 0 N-CA-C 109.634 -0.506 . . . . 55.34 109.634 173.376 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 56.71 101.54 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 125.034 1.334 . . . . 71.13 111.457 -175.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 . . . . . 0 N--CA 1.497 1.887 0 C-N-CA 124.768 1.227 . . . . 64.41 113.92 -173.547 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 74.9 p . . . . . 0 N--CA 1.483 1.203 0 CA-C-O 120.421 0.153 . . . . 73.43 110.946 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 80.8 t60 -89.28 123.97 33.98 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.189 0.596 . . . . 71.24 109.94 175.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.1 mmt -79.61 157.78 27.23 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.789 0.836 . . . . 72.34 111.867 -177.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.3 t -136.21 163.17 31.01 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.464 0.705 . . . . 63.31 111.271 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -71.33 139.14 49.76 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 123.711 0.804 . . . . 73.31 110.254 177.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.531 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 0.0 OUTLIER -68.87 120.11 14.27 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.456 0.702 . . . . 73.3 111.15 -174.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 95.91 -29.94 9.2 Favored Glycine 0 CA--C 1.539 1.554 0 CA-C-N 116.379 -0.373 . . . . 64.23 113.267 -175.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -80.81 95.15 6.59 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.533 0.733 . . . . 74.54 110.012 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -101.56 24.0 10.36 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.163 0.985 . . . . 75.45 111.878 -175.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -71.58 89.5 0.98 Allowed 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 123.197 0.599 . . . . 70.31 110.767 -175.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -140.05 126.2 19.85 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 124.2 1.0 . . . . 75.22 109.546 174.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -104.76 109.3 21.19 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.489 0.715 . . . . 74.44 110.815 -178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.8 ptt180 -86.22 -6.24 59.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.503 0.721 . . . . 62.54 112.19 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.2 p -81.64 -57.12 3.59 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.702 0.801 . . . . 61.1 111.672 -176.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 32.0 m -127.16 135.57 50.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.124 0.97 . . . . 64.53 108.561 175.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 65.58 163.52 0.16 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 124.774 1.23 . . . . 43.33 111.983 -169.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.2 p -114.21 171.06 7.84 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 123.063 0.545 . . . . 75.11 110.135 172.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.448 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 79.7 p -59.8 -46.86 87.9 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.144 0.578 . . . . 71.43 111.115 176.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -56.33 -51.26 68.92 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.938 0.895 . . . . 73.1 112.098 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -58.6 -48.38 81.16 Favored 'General case' 0 N--CA 1.483 1.195 0 CA-C-N 116.271 -0.422 . . . . 74.15 110.94 -178.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -59.7 -32.42 70.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 64.04 112.352 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 18' ' ' SER . 72.3 mm-40 -65.14 -52.03 57.67 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 122.549 0.34 . . . . 74.25 111.119 175.693 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.418 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 18.5 mm-40 -60.74 -46.06 91.9 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.221 0.608 . . . . 74.22 111.725 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.54 HD23 HD21 ' A' ' 42' ' ' LEU . 59.1 mt -57.3 -47.53 81.24 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 124.407 1.083 . . . . 75.13 111.179 176.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -63.84 -36.58 84.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.174 0.99 . . . . 75.34 112.424 176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 52.5 mtpt -58.55 -35.94 73.12 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 122.853 0.461 . . . . 72.53 111.601 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 52.0 t -80.27 -39.57 19.2 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.257 0 C-N-CA 122.817 0.447 . . . . 72.53 111.087 175.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 81.3 t80 -63.39 -40.02 96.08 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.103 0.961 . . . . 44.4 112.9 -177.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 87.7 mm-40 -74.39 -28.42 61.08 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.423 0.689 . . . . 72.42 111.461 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.0 mtmt -74.19 -47.69 33.99 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 122.531 0.332 . . . . 72.32 110.404 172.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.1 t -148.95 135.7 19.69 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.377 0.671 . . . . 63.12 111.019 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.3 m80 -81.86 -9.98 59.44 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.489 0.715 . . . . 74.45 111.117 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -119.44 86.72 34.51 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 124.164 0.985 . . . . 74.25 109.504 178.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -77.22 134.87 14.65 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.372 2.048 . . . . 72.13 112.891 -178.09 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.31 160.2 25.04 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.254 0.622 . . . . 64.11 111.269 175.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.445 ' HA ' ' HD2' ' A' ' 39' ' ' ARG . 9.7 p -58.48 -34.85 51.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 122.856 0.462 . . . . 75.21 111.546 175.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -72.66 -35.32 67.7 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.606 0.762 . . . . 53.12 111.071 177.312 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.57 -39.29 94.0 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.252 0.621 . . . . 73.13 111.139 174.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.445 ' HD2' ' HA ' ' A' ' 36' ' ' VAL . 77.7 mtt180 -63.75 -39.61 94.69 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.053 0.941 . . . . 75.41 111.116 177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -63.0 -57.36 10.96 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.526 0.731 . . . . 73.41 111.907 177.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -56.43 -42.29 77.84 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.586 0.754 . . . . 75.34 111.537 -179.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.54 HD21 HD23 ' A' ' 24' ' ' LEU . 31.7 tp -67.49 -39.98 85.21 Favored 'General case' 0 CA--C 1.549 0.94 0 CA-C-N 115.078 -0.965 . . . . 61.33 111.952 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.36 -31.42 72.53 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 123.214 0.606 . . . . 73.53 111.568 177.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 60.2 mtt -69.98 -40.22 75.48 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.436 0.694 . . . . 62.21 111.029 174.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -65.05 -44.98 87.26 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.677 0.791 . . . . 72.52 111.693 177.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.7 p -94.45 -9.13 36.52 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.644 0.777 . . . . 71.24 112.953 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 63.28 19.69 11.82 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 124.247 1.019 . . . . 75.03 112.386 -175.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.6 mt -92.35 173.93 7.55 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.331 0.652 . . . . 75.34 110.706 177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.5 p -88.36 152.59 21.81 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 122.863 0.465 . . . . 73.21 110.461 172.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -57.13 -34.37 68.31 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.726 0.81 . . . . 62.21 110.774 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -57.72 -50.48 73.06 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.869 0.868 . . . . 71.44 111.979 172.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.8 ttm180 -68.39 -31.65 71.15 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.243 0.617 . . . . 71.42 112.39 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -59.51 -47.35 91.15 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.28 0 C-N-CA 122.922 0.489 . . . . 74.11 110.144 172.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -63.21 -41.74 99.19 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.634 0.774 . . . . 74.14 112.672 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -59.34 -43.94 91.28 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 C-N-CA 122.475 0.31 . . . . 65.24 110.623 176.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.9 t90 -60.53 -54.28 47.32 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 123.562 0.539 . . . . 73.14 110.406 178.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -60.39 -46.81 88.65 Favored 'General case' 0 N--CA 1.488 1.47 0 N-CA-C 113.279 0.844 . . . . 71.21 113.279 -176.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -69.44 -37.85 77.55 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-N 118.332 0.515 . . . . 61.51 111.792 -177.216 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -68.9 -36.22 77.78 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.805 0.842 . . . . 65.22 111.078 174.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 30.5 tpt180 -70.75 -40.59 72.6 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.288 1.035 . . . . 73.32 110.624 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 65.3 mtp180 -68.99 -37.67 78.87 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 124.68 1.192 . . . . 51.14 111.397 177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -59.52 -47.97 83.48 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 123.241 0.617 . . . . 75.24 110.801 175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -74.17 -24.49 59.4 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.577 0.751 . . . . 73.34 112.53 177.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 74.1 t90 -75.1 -28.32 60.22 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.276 0.631 . . . . 64.22 110.624 175.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 -83.1 8.58 12.56 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 123.77 0.828 . . . . 73.33 112.729 176.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 10.9 tmtt? -67.5 111.48 4.15 Favored 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 123.129 0.572 . . . . 74.53 109.905 178.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -83.29 151.85 25.41 Favored 'General case' 0 CA--C 1.564 1.49 0 C-N-CA 124.443 1.097 . . . . 71.1 110.859 178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 73.84 97.98 0.07 Allowed 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 125.11 1.364 . . . . 51.2 112.526 179.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 62.6 ttp180 -111.39 111.29 22.23 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.138 0.975 . . . . 75.22 109.064 174.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 22.7 p90 -145.09 121.73 11.13 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.236 0.614 . . . . 71.43 111.119 -174.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 63.54 -83.75 0.05 OUTLIER Glycine 0 N--CA 1.481 1.637 0 C-N-CA 123.045 0.355 . . . . 44.22 113.68 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 32.1 mm-40 67.68 -83.83 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 125.786 1.634 . . . . 72.41 111.675 178.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.4 ttt 51.81 35.4 15.35 Favored 'General case' 0 CA--C 1.57 1.713 0 C-N-CA 124.125 0.97 . . . . 75.12 111.666 179.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -74.47 83.97 1.99 Allowed 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 115.247 -0.888 . . . . 61.32 111.501 -173.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 . . . . . 0 CA--C 1.561 1.378 0 C-N-CA 124.726 1.21 . . . . 71.21 109.065 179.054 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.49 1.566 0 CA-C-O 120.499 0.19 . . . . 73.11 111.493 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 7.6 p-80 -166.55 -27.41 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 124.136 0.974 . . . . 62.41 111.52 173.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.1 tmt? -62.93 -49.09 76.14 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.426 0.69 . . . . 73.51 110.345 179.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 46.9 t -114.12 136.94 52.38 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.837 0.855 . . . . 75.1 109.604 170.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -101.73 -48.24 4.36 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.217 0.607 . . . . 71.52 110.819 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 23.2 tptm 65.17 140.68 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 125.254 1.422 . . . . 73.32 113.697 176.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 93.05 -143.0 16.22 Favored Glycine 0 C--N 1.348 1.242 0 CA-C-N 116.393 -0.367 . . . . 45.2 113.532 173.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.4 mtpm? -73.39 145.54 45.79 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.266 0.626 . . . . 75.12 112.491 -177.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -155.18 141.36 18.47 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.099 0.96 . . . . 70.3 109.583 179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 76.2 mtt180 -64.61 96.79 0.18 Allowed 'General case' 0 N--CA 1.481 1.087 0 CA-C-O 121.597 0.713 . . . . 71.15 111.589 177.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 35.9 ttt180 -74.21 -24.12 59.3 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.521 1.128 . . . . 74.32 111.732 -178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 52.1 t30 -62.4 127.37 31.03 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.51 0.724 . . . . 61.4 111.379 -178.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -93.75 161.04 14.49 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 124.254 1.022 . . . . 71.32 111.383 179.883 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.5 p -130.42 -70.67 0.61 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.193 0.597 . . . . 62.4 110.254 172.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 22.9 m -111.39 157.04 20.7 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.968 0.907 . . . . 65.32 109.329 -178.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 67.31 -178.43 0.21 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 124.907 1.283 . . . . 64.03 111.775 -177.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -141.01 173.91 11.02 Favored 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 122.798 0.439 . . . . 45.41 111.276 177.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 47.3 t -52.48 -46.89 66.74 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 124.077 0.951 . . . . 63.42 112.629 -177.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -61.49 -52.87 62.73 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.267 0.627 . . . . 73.34 112.082 178.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -57.09 -50.12 73.77 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 122.967 0.507 . . . . 63.33 111.322 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -59.95 -41.12 91.16 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.229 0.611 . . . . 72.31 111.715 177.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.92 -36.13 72.05 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 123.789 0.836 . . . . 75.41 111.586 179.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 33.6 mm-40 -80.98 -39.06 26.58 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 123.773 0.829 . . . . 71.31 112.339 177.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.578 HD23 HD21 ' A' ' 42' ' ' LEU . 66.5 mt -64.22 -43.38 95.15 Favored 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 123.907 0.883 . . . . 74.21 111.404 -179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.453 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 21.7 mm-40 -53.72 -46.89 70.96 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.983 1.313 . . . . 73.01 111.707 176.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -49.26 -56.03 10.73 Favored 'General case' 0 N--CA 1.499 1.987 0 C-N-CA 123.87 0.868 . . . . 73.14 111.547 178.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 47.7 t -67.98 -31.01 50.14 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 114.969 -1.014 . . . . 73.24 112.008 -173.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -68.85 -35.7 77.25 Favored 'General case' 0 N--CA 1.498 1.96 0 C-N-CA 123.016 0.526 . . . . 73.34 111.24 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.453 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.0 mm-40 -77.53 -26.17 50.83 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 123.388 0.675 . . . . 71.33 111.644 178.295 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -78.61 -43.69 25.76 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.184 0.594 . . . . 75.21 110.898 174.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.2 t -156.67 127.22 6.63 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.357 1.063 . . . . 71.24 110.416 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 55.4 m80 -70.32 -13.28 62.09 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 122.015 -0.428 . . . . 73.22 112.145 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 10.4 p90 -134.9 92.39 18.87 Favored Pre-proline 0 CA--C 1.564 1.504 0 C-N-CA 123.872 0.869 . . . . 73.53 110.921 179.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.1 Cg_exo -73.7 129.92 14.13 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.56 2.173 . . . . 70.14 112.348 171.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.409 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 3.5 p-10 -70.8 169.35 14.78 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.462 0.705 . . . . 74.3 110.75 171.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.6 p -53.24 -32.97 19.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 N-CA-C 113.068 0.766 . . . . 74.42 113.068 -175.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 63.0 t80 -80.52 -37.85 30.8 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.762 0.825 . . . . 71.23 111.05 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.78 -32.4 73.91 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.174 0.59 . . . . 41.44 111.514 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 64.9 mtt180 -70.56 -35.06 72.89 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.196 0.598 . . . . 72.12 110.63 174.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -60.97 -46.09 92.13 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.575 0.75 . . . . 72.22 112.431 175.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 -58.47 -45.04 89.43 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.485 0.66 . . . . 64.23 110.725 176.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD21 HD23 ' A' ' 24' ' ' LEU . 43.8 tp -70.03 -32.95 71.35 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 114.693 -1.139 . . . . 52.22 112.117 178.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -71.22 -32.39 68.74 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.762 0.825 . . . . 75.42 111.411 177.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.3 mmt -77.27 -7.01 55.26 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.127 0.571 . . . . 74.52 111.735 173.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 17.6 mmt85 -91.19 -49.08 6.57 Favored 'General case' 0 CA--C 1.555 1.153 0 C-N-CA 123.454 0.702 . . . . 70.44 110.743 167.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.9 p -104.73 -4.96 21.75 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 114.867 1.432 . . . . 71.33 114.867 -164.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 64.86 13.29 8.42 Favored 'General case' 0 N--CA 1.501 2.107 0 C-N-CA 124.384 1.074 . . . . 74.01 113.088 -175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.3 mt -87.83 145.17 26.21 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 121.176 0.513 . . . . 71.1 112.22 -174.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 89.0 m -73.35 153.46 40.48 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 124.624 1.17 . . . . 74.2 110.616 174.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -39.55 -46.45 1.75 Allowed 'General case' 0 N--CA 1.498 1.967 0 C-N-CA 123.948 0.899 . . . . 71.25 112.425 171.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.443 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.6 -60.12 3.71 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 123.675 0.79 . . . . 72.52 111.776 175.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -62.77 -33.67 75.65 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 113.179 0.807 . . . . 71.1 113.179 -175.619 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.9 t -62.58 -56.09 19.71 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.046 0.538 . . . . 72.35 109.728 174.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -58.93 -40.66 85.27 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.222 0.609 . . . . 75.23 112.03 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 51' ' ' ALA . 58.4 t -58.21 -48.25 85.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 123.682 0.793 . . . . 73.24 111.498 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.435 ' O ' ' HD3' ' A' ' 60' ' ' ARG . 86.2 t90 -56.85 -55.51 33.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.934 0.494 . . . . 63.44 110.261 178.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.409 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 65.2 m-85 -59.47 -41.06 88.87 Favored 'General case' 0 N--CA 1.477 0.916 0 CA-C-N 115.792 -0.64 . . . . 72.34 112.011 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -65.51 -45.17 84.58 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 112.983 0.734 . . . . 73.41 112.983 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -69.75 -34.56 73.98 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 118.117 0.417 . . . . 60.33 110.058 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.435 ' HD3' ' O ' ' A' ' 56' ' ' TRP . 9.7 mpt_? -60.77 -47.19 87.42 Favored 'General case' 0 N--CA 1.483 1.221 0 CA-C-O 119.218 -0.42 . . . . 70.5 110.822 173.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 93.5 mtt180 -65.62 -40.87 93.06 Favored 'General case' 0 N--CA 1.497 1.905 0 C-N-CA 124.299 1.039 . . . . 74.33 111.684 -179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.51 -37.89 86.04 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.228 0.611 . . . . 51.54 111.721 -178.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG2' HE22 ' A' ' 72' ' ' GLN . 86.2 mttt -82.94 -24.58 32.96 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.406 0.682 . . . . 75.03 111.756 177.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 72.0 t90 -78.26 -53.3 7.47 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.498 1.119 . . . . 73.31 111.318 -178.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 44.1 ttm180 -89.05 66.07 7.67 Favored 'General case' 0 CA--C 1.554 1.13 0 CA-C-O 122.229 1.014 . . . . 73.13 111.275 -177.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -137.48 144.92 42.48 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.112 0.965 . . . . 51.42 109.274 169.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -73.75 -40.05 63.79 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.213 0.605 . . . . 73.14 109.798 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -77.65 124.42 27.91 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.527 -1.286 . . . . 75.55 107.527 160.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -161.36 -41.5 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 CA-C-N 118.6 0.636 . . . . 74.05 112.351 -177.078 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -50.36 -54.36 22.23 Favored 'General case' 0 N--CA 1.494 1.764 0 C-N-CA 124.353 1.061 . . . . 74.03 112.259 -176.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -113.42 72.15 0.23 Allowed Glycine 0 N--CA 1.47 0.938 0 CA-C-N 115.63 -0.714 . . . . 35.12 111.33 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.446 HE22 ' HG2' ' A' ' 63' ' ' LYS . 53.2 tt0 -66.27 111.58 3.54 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.967 0.507 . . . . 73.42 110.696 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 53.3 mtm -65.35 106.55 1.39 Allowed 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 124.154 0.982 . . . . 74.55 112.144 -171.623 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -141.92 137.03 31.02 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 108.593 -0.892 . . . . 75.41 108.593 178.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 52.0 tt0 . . . . . 0 N--CA 1.492 1.629 0 C-N-CA 123.844 0.858 . . . . 72.23 112.364 -173.156 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.4 p . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 120.675 0.274 . . . . 64.12 111.051 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 33.1 t-80 -123.83 124.29 42.34 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.776 0.83 . . . . 74.42 109.511 174.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.29 156.84 18.08 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.021 0.928 . . . . 74.15 111.573 -178.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 69.9 m -146.14 103.02 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 124.064 0.946 . . . . 62.14 109.04 173.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 30.6 p-10 -75.57 -6.42 50.2 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 113.412 0.893 . . . . 71.24 113.412 -172.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -103.68 114.04 28.01 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.771 0.829 . . . . 71.42 110.898 178.086 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.49 71.01 2.89 Favored Glycine 0 C--N 1.351 1.38 0 N-CA-C 111.895 -0.482 . . . . 72.22 111.895 175.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -78.8 130.0 35.24 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.596 0.758 . . . . 61.04 112.197 -173.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 61.9 tttp -75.91 106.44 7.49 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 122.953 0.501 . . . . 72.51 110.755 174.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -157.5 -76.01 0.09 Allowed 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 109.665 -0.494 . . . . 74.3 109.665 172.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 27.9 mtm180 -136.56 142.25 43.38 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.615 0.766 . . . . 74.31 110.478 -179.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -96.44 60.73 1.93 Allowed 'General case' 0 CA--C 1.556 1.187 0 N-CA-C 107.852 -1.166 . . . . 73.31 107.852 166.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 64.11 10.23 5.29 Favored 'General case' 0 N--CA 1.498 1.969 0 C-N-CA 125.37 1.468 . . . . 72.45 112.184 -172.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.1 p -80.26 93.9 5.98 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.934 0.894 . . . . 73.03 111.73 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.7 p -94.38 1.77 55.82 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.204 0.601 . . . . 74.33 111.536 172.235 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -120.28 160.09 23.67 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 124.245 1.018 . . . . 74.51 111.251 -178.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 44.1 p -103.64 -178.17 3.58 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.961 0.904 . . . . 75.52 110.819 175.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 45.9 t -57.64 -63.24 1.31 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.408 0.683 . . . . 51.42 112.038 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -54.72 -44.42 73.49 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.704 0.802 . . . . 74.15 111.927 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -56.66 -49.72 74.21 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.174 0.59 . . . . 73.44 111.479 179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 58.5 mt -64.25 -41.88 96.75 Favored 'General case' 0 N--CA 1.483 1.222 0 N-CA-C 112.635 0.606 . . . . 74.34 112.635 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.11 -37.12 83.9 Favored 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 123.368 0.667 . . . . 75.32 112.018 179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -72.45 -45.93 57.3 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.179 0.991 . . . . 64.12 112.293 176.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.674 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.98 -47.11 83.93 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.581 0.753 . . . . 75.44 111.091 176.1 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 46.5 mm-40 -63.6 -37.61 87.99 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.415 1.086 . . . . 73.51 111.857 176.413 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 61.4 tttp -57.07 -52.54 64.87 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.648 0.379 . . . . 62.03 110.906 176.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.9 t -67.12 -29.2 45.26 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.187 0 C-N-CA 123.446 0.698 . . . . 53.03 111.486 177.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -67.84 -36.49 80.44 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 123.483 0.713 . . . . 73.35 111.618 175.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.488 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 76.1 mm-40 -81.6 -19.75 41.23 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.008 0.523 . . . . 55.21 111.391 178.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -73.98 -45.45 49.98 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.339 0.59 . . . . 71.25 110.295 168.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.9 t -160.68 149.11 16.4 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.044 0.938 . . . . 72.35 111.487 -174.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.774 ' HB3' ' HD3' ' A' ' 61' ' ' ARG . 48.3 m80 -82.88 -23.92 33.4 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.088 0.555 . . . . 71.43 111.148 176.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -116.15 100.62 53.64 Favored Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 123.794 0.838 . . . . 73.15 109.64 177.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -69.71 131.69 21.84 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.012 1.808 . . . . 71.4 111.783 178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -74.2 157.96 34.98 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.253 0.621 . . . . 65.22 111.05 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.1 p -54.18 -39.58 43.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 N-CA-C 113.424 0.898 . . . . 73.42 113.424 -171.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.1 t80 -81.79 -34.14 30.49 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.011 0.524 . . . . 71.12 111.528 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.45 -33.24 74.44 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.231 0.612 . . . . 72.51 111.46 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 39' ' ' ARG . 61.2 mtt-85 -65.07 -39.34 93.1 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.107 0.963 . . . . 55.15 110.995 173.107 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mm-40 -65.49 -46.27 80.4 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.323 0.649 . . . . 75.32 111.678 177.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.422 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 48.7 mt-30 -59.03 -48.71 80.61 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.157 0.583 . . . . 74.32 110.451 176.59 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.674 HD21 HD23 ' A' ' 24' ' ' LEU . 35.9 tp -60.64 -45.73 92.96 Favored 'General case' 0 CA--C 1.555 1.166 0 CA-C-N 115.042 -0.981 . . . . 75.43 111.616 177.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.17 -44.27 95.94 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.123 0.969 . . . . 74.03 113.075 -175.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.0 ptt? -71.83 -31.65 66.75 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 112.628 0.603 . . . . 72.52 112.628 -177.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.422 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 58.5 mtp180 -77.47 -42.98 33.89 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.582 0.353 . . . . 71.32 111.484 178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 71.7 p -80.63 -25.71 38.18 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 112.625 0.602 . . . . 62.01 112.625 -177.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.8 t70 64.55 64.03 0.71 Allowed 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.231 1.012 . . . . 44.13 109.722 -167.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.7 mt -133.58 147.2 51.51 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.364 1.066 . . . . 65.23 110.942 177.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 91.2 m -76.01 148.57 37.96 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.715 0.806 . . . . 75.31 111.147 175.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -50.46 -41.92 53.59 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.092 0.957 . . . . 73.22 112.902 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -61.47 -44.27 97.39 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.249 0.62 . . . . 73.4 111.695 175.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 tpm_? -63.35 -37.9 89.05 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.716 0.806 . . . . 70.42 111.733 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.4 t -68.78 -47.76 74.6 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 C-N-CA 124.23 1.012 . . . . 71.24 111.163 176.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -60.7 -47.24 87.17 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.022 0.929 . . . . 72.43 112.355 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 90.2 t -62.81 -35.33 70.46 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 C-N-CA 122.368 0.267 . . . . 62.4 111.03 177.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 80.1 t90 -59.97 -54.39 46.58 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 122.408 0.283 . . . . 75.23 111.522 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -62.23 -28.64 69.83 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 112.943 0.72 . . . . 74.3 112.943 -177.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -75.19 -48.0 25.65 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.119 0.567 . . . . 54.23 111.132 174.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -66.57 -34.14 77.24 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 124.415 1.086 . . . . 42.52 110.938 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 18.2 tpt85 -71.0 -44.05 66.71 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.151 1.38 . . . . 72.33 110.557 178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.774 ' HD3' ' HB3' ' A' ' 32' ' ' HIS . 34.3 mtm180 -70.72 -21.64 62.52 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 112.464 0.542 . . . . 73.02 112.464 174.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.67 -41.01 84.38 Favored 'General case' 0 N--CA 1.485 1.297 0 CA-C-O 121.166 0.508 . . . . 74.32 110.59 172.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.9 tttp -80.73 -27.11 36.99 Favored 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 123.939 0.895 . . . . 74.2 111.998 177.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.531 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.2 t90 -73.37 -33.81 65.25 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 123.531 0.732 . . . . 73.43 110.141 174.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -78.91 -30.25 44.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.243 1.017 . . . . 73.25 111.007 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -143.25 107.84 4.84 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.406 0.682 . . . . 72.23 109.831 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 24.7 ttp180 -43.99 -61.95 1.29 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.838 1.655 . . . . 64.25 114.359 -171.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 55.96 65.87 1.34 Allowed 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 124.65 1.18 . . . . 73.34 112.925 -175.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 39.7 ttt180 -171.06 103.07 0.22 Allowed 'General case' 0 CA--C 1.552 1.033 0 CA-C-N 114.845 -1.07 . . . . 74.23 109.902 175.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.0 m-85 -94.19 -17.5 22.66 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.444 0.698 . . . . 72.24 111.518 -179.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.08 -107.26 3.42 Favored Glycine 0 C--N 1.347 1.176 0 CA-C-N 116.307 -0.406 . . . . 64.42 112.855 -179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -125.68 136.85 53.67 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.792 0.837 . . . . 52.11 111.198 -177.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 83.2 mtp -77.68 99.35 5.79 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.343 0.657 . . . . 73.01 110.483 173.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -86.38 96.39 9.99 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.275 0.63 . . . . 72.22 111.504 -176.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 . . . . . 0 N--CA 1.491 1.582 0 C-N-CA 124.447 1.099 . . . . 71.12 110.038 170.751 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.597 0.237 . . . . 71.23 110.443 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.29 162.76 26.53 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.312 0.645 . . . . 75.45 112.109 179.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 47.1 ttp 72.35 -1.75 2.83 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 124.954 1.301 . . . . 75.15 112.297 -178.111 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -115.37 83.49 1.93 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.874 0.869 . . . . 72.44 109.312 177.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -111.36 95.15 5.34 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.772 0.829 . . . . 73.05 110.868 -174.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -153.7 135.41 14.46 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 124.02 0.928 . . . . 73.31 109.321 175.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -70.43 165.89 51.47 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 121.605 -0.331 . . . . 52.3 112.553 171.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.4 mmtp 63.84 96.1 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 124.661 1.185 . . . . 74.4 112.559 177.631 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -96.93 139.3 33.17 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.437 0.695 . . . . 63.11 110.246 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -146.75 -64.51 0.29 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 122.143 -0.348 . . . . 74.15 111.743 -176.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.1 ttt180 -83.24 -1.39 53.0 Favored 'General case' 0 N--CA 1.5 2.037 0 C-N-CA 122.975 0.51 . . . . 74.14 112.024 -178.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -62.58 142.7 57.88 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.384 0.674 . . . . 75.11 112.086 177.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -66.92 100.16 0.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.182 0.593 . . . . 74.23 111.227 -178.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 25.8 m -101.03 -47.94 4.59 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.417 -0.811 . . . . 75.34 111.514 -174.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 68.9 p -96.58 -62.45 1.27 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.464 0.706 . . . . 51.02 111.266 -176.225 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -97.84 135.2 39.94 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.631 0.772 . . . . 64.01 110.01 177.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 25.2 p -77.92 170.21 16.98 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 122.858 0.463 . . . . 72.24 111.311 178.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 80.0 p -58.78 -49.04 79.14 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.361 0.664 . . . . 55.22 112.494 -176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -61.86 -42.59 99.23 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.121 0.568 . . . . 55.34 111.722 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.0 mt-30 -58.29 -46.56 85.86 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 122.704 0.402 . . . . 71.02 110.733 178.34 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.5 mt -64.27 -31.53 72.76 Favored 'General case' 0 CA--C 1.554 1.124 0 C-N-CA 123.802 0.841 . . . . 62.44 112.355 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -61.44 -47.74 84.36 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 122.915 0.486 . . . . 62.22 111.581 177.051 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -75.44 -41.48 55.72 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 116.371 -0.377 . . . . 73.54 111.901 -177.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 95.7 mt -57.91 -45.47 86.45 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 123.239 0.616 . . . . 75.05 111.169 176.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.7 mm-40 -65.98 -47.16 75.48 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.349 0.66 . . . . 51.44 111.888 175.068 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -49.38 -50.43 40.31 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.116 0.966 . . . . 70.21 112.272 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 49.0 t -71.95 -31.98 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.305 0 CA-C-N 115.433 -0.803 . . . . 61.14 111.174 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -67.91 -34.68 77.09 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.06 0.544 . . . . 74.41 111.603 174.832 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.468 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 30.1 mm-40 -71.98 -27.7 62.93 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 122.91 0.484 . . . . 74.42 111.444 -179.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.1 mtpt -83.21 -54.99 4.61 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.071 0.549 . . . . 74.34 110.926 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.3 t -136.49 126.44 25.92 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.157 0.983 . . . . 65.25 110.555 -178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -70.38 -33.87 71.92 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.737 0.415 . . . . 72.15 110.838 -179.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 89.8 m-85 -116.91 85.64 18.01 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 124.283 1.033 . . . . 72.51 109.524 175.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -65.12 135.4 43.46 Favored 'Trans proline' 0 C--N 1.375 1.939 0 C-N-CA 122.613 2.209 . . . . 32.32 113.356 178.329 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.498 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 4.5 p-10 -66.32 165.83 13.32 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.186 0.994 . . . . 61.23 111.771 177.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.469 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 10.7 p -55.3 -38.27 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 C-N-CA 123.515 0.726 . . . . 65.3 112.86 -174.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -69.95 -37.67 75.91 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.993 0.517 . . . . 75.31 110.819 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.61 -33.37 75.45 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.423 0.689 . . . . 73.2 111.308 173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 35' ' ' ASP . 15.0 mmm180 -71.93 -35.97 69.81 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.383 0.673 . . . . 64.01 111.011 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 10.8 mm-40 -60.83 -59.35 5.51 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.572 0.749 . . . . 71.31 111.08 177.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 45' ' ' ARG . 29.1 mm-40 -60.39 -43.03 97.01 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.674 0.79 . . . . 64.05 112.111 -179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.1 tp -60.5 -39.73 88.79 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.568 0.747 . . . . 71.42 111.701 177.193 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.63 -36.01 81.54 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.172 0.589 . . . . 63.31 111.951 176.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.1 mtp -69.88 -32.72 71.22 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.709 0.804 . . . . 72.42 111.972 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.4 ' HG3' ' O ' ' A' ' 41' ' ' GLN . 44.9 mtt180 -71.51 -52.84 16.16 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 123.808 0.843 . . . . 74.53 111.197 177.584 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 82.3 p -84.9 -14.89 46.39 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-N 115.168 -0.924 . . . . 72.34 113.396 -170.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.3 t70 67.5 8.44 6.32 Favored 'General case' 0 CA--C 1.573 1.842 0 C-N-CA 124.519 1.127 . . . . 73.41 111.585 -173.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 78.5 mt -91.53 139.25 30.89 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.667 0.787 . . . . 75.13 110.273 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.8 m -66.39 147.29 53.52 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.035 0.534 . . . . 70.03 110.39 176.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -51.64 -33.04 31.73 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.867 0.867 . . . . 65.21 110.985 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.405 ' HA ' HE21 ' A' ' 54' ' ' GLN . . . -55.8 -51.19 68.32 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.898 0.879 . . . . 75.25 112.512 171.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? -65.19 -35.26 80.54 Favored 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 123.127 0.571 . . . . 65.2 111.985 177.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 48.0 t -68.11 -32.83 57.69 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.468 0 C-N-CA 123.525 0.73 . . . . 65.43 110.73 177.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.405 HE21 ' HA ' ' A' ' 51' ' ' ALA . 46.3 mt-30 -62.71 -51.5 66.94 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.118 0.567 . . . . 72.35 110.663 172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.4 t -55.38 -47.08 78.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 C-N-CA 123.603 0.761 . . . . 40.34 111.676 -178.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 72.7 t90 -60.34 -55.75 29.88 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 116.31 -0.405 . . . . 74.13 110.863 179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.407 ' O ' ' HG3' ' A' ' 61' ' ' ARG . 20.6 m-85 -60.49 -42.05 95.51 Favored 'General case' 0 N--CA 1.484 1.243 0 N-CA-C 112.829 0.677 . . . . 75.11 112.829 -176.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.7 mt-30 -69.6 -39.44 77.26 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.469 0.544 . . . . 72.32 112.469 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.2 m-80 -70.09 -32.39 70.42 Favored 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 120.686 0.279 . . . . 72.24 111.277 172.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 13.9 tpt180 -67.41 -38.66 84.97 Favored 'General case' 0 CA--C 1.556 1.202 0 C-N-CA 123.884 0.874 . . . . 74.51 110.757 176.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 57' ' ' PHE . 78.4 mtt180 -73.76 -34.88 64.89 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 124.078 0.951 . . . . 73.25 111.453 176.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.4 -39.82 85.59 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.316 0.647 . . . . 53.01 111.794 -177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.26 -25.22 34.27 Favored 'General case' 0 CA--C 1.562 1.419 0 C-N-CA 123.085 0.554 . . . . 74.54 110.807 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 63.2 t90 -68.36 -30.25 69.15 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.056 0.942 . . . . 74.32 111.196 168.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 5.0 tpt180 -73.71 117.85 15.97 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.798 0.839 . . . . 70.34 109.959 -177.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 1.1 ttmp? -67.0 133.91 50.89 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.022 0.529 . . . . 75.44 112.249 -175.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 78.0 mtp180 60.93 97.12 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 125.121 1.368 . . . . 54.0 111.616 -171.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -68.11 122.56 18.54 Favored 'General case' 0 CA--C 1.549 0.931 0 CA-C-N 115.729 -0.669 . . . . 64.13 110.021 179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 63.6 ttt180 -59.03 97.47 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.669 0.788 . . . . 65.55 111.045 179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 36.7 t80 56.95 45.34 21.44 Favored 'General case' 0 CA--C 1.567 1.623 0 C-N-CA 124.576 1.15 . . . . 75.31 111.22 -174.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -80.28 -74.59 1.1 Allowed Glycine 0 C--N 1.351 1.376 0 CA-C-N 115.794 -0.639 . . . . 52.32 112.599 -179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -97.71 4.05 50.06 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.345 0.658 . . . . 74.03 112.134 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.3 mtm 68.67 143.52 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 125.406 1.482 . . . . 73.24 112.477 178.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 66.04 106.47 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 124.471 1.108 . . . . 72.55 112.056 176.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 CA--C 1.573 1.835 0 C-N-CA 124.494 1.117 . . . . 74.2 111.879 -173.744 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.8 m . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.467 0.175 . . . . 72.11 111.168 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 66.4 t-80 -101.72 132.5 47.4 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.468 0.707 . . . . 74.51 109.736 175.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -64.93 123.54 19.71 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.225 0.61 . . . . 60.1 110.84 178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.5 p -80.41 92.34 5.82 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.346 0.658 . . . . 54.32 111.405 -175.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 48.0 t30 -107.26 96.38 6.38 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.407 0.683 . . . . 74.02 109.813 176.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -114.48 115.48 27.31 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.704 0.802 . . . . 65.1 109.043 176.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -87.54 51.04 4.11 Favored Glycine 0 N--CA 1.479 1.559 0 N-CA-C 114.338 0.495 . . . . 74.13 114.338 -176.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 4.6 mptp? -99.73 84.85 2.99 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.574 0.75 . . . . 71.4 109.326 175.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.25 110.76 6.91 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.992 0.917 . . . . 63.5 109.085 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 63.4 mtt-85 -91.96 -93.52 0.14 Allowed 'General case' 0 CA--C 1.559 1.324 0 C-N-CA 122.953 0.501 . . . . 71.34 110.051 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.5 ptp180 174.77 141.54 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.273 1.429 . . . . 72.42 109.945 -179.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -90.82 130.42 36.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.096 0.558 . . . . 73.53 110.441 176.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 46.6 ttp180 -89.45 121.54 31.78 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.822 -0.807 . . . . 73.54 108.822 173.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 78.7 p -66.42 101.84 0.8 Allowed 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 123.516 0.726 . . . . 62.2 111.893 -171.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 77.7 p -73.91 121.3 20.75 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 124.062 0.945 . . . . 55.31 110.923 -179.114 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.4 m-85 60.77 -165.62 0.21 Allowed 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 124.119 0.967 . . . . 74.34 111.364 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.5 t -110.44 169.08 8.98 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.917 -0.489 . . . . 75.12 110.462 166.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.2 t -58.04 -41.01 82.36 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.788 0.835 . . . . 73.12 111.993 -177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 90.8 t80 -64.11 -47.5 79.76 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.196 0.599 . . . . 62.32 111.545 178.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.43 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 97.7 mt-30 -57.32 -50.5 72.75 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 122.708 0.403 . . . . 73.54 111.504 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.4 mt -60.2 -36.55 77.91 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 123.488 0.715 . . . . 64.44 112.012 176.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -63.23 -41.0 99.05 Favored 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 123.8 0.84 . . . . 71.54 110.955 178.607 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -74.34 -45.79 44.88 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.798 0.839 . . . . 72.41 111.702 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.458 HD23 HD21 ' A' ' 42' ' ' LEU . 84.6 mt -55.14 -44.44 75.1 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.908 0.883 . . . . 62.3 111.056 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.51 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 41.8 tt0 -69.29 -33.84 73.81 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 123.309 0.644 . . . . 65.21 112.601 -179.227 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.4 mttp -55.3 -49.3 72.5 Favored 'General case' 0 N--CA 1.503 2.208 0 C-N-CA 122.93 0.492 . . . . 61.33 111.483 175.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 91.0 t -64.91 -39.33 85.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 115.602 -0.726 . . . . 74.4 110.878 177.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 60.3 t80 -62.62 -31.21 72.02 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.844 0.858 . . . . 75.12 112.064 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.51 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 87.5 mm-40 -70.54 -48.87 53.34 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.103 0.561 . . . . 72.24 111.468 177.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 50.7 mtpt -71.15 -37.26 72.24 Favored 'General case' 0 N--CA 1.487 1.381 0 CA-C-O 121.041 0.448 . . . . 64.42 111.706 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.1 t -155.69 112.31 3.17 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.896 0.879 . . . . 61.44 110.676 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 69.4 m80 -65.46 -27.28 68.39 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.094 0.557 . . . . 71.11 111.903 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 88.2 m-85 -100.02 100.26 11.08 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 124.27 1.028 . . . . 72.2 109.608 176.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -79.36 119.18 4.1 Favored 'Trans proline' 0 CA--C 1.561 1.825 0 C-N-CA 122.309 2.006 . . . . 65.03 112.659 -178.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -67.88 170.81 7.49 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.098 0.959 . . . . 63.24 111.276 174.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.6 p -61.72 -43.01 96.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 111.988 0.366 . . . . 62.54 111.988 -178.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -70.61 -36.27 73.42 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.037 0.535 . . . . 74.5 110.244 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.62 -41.36 97.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.358 0.663 . . . . 53.13 111.573 175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 71.4 mtm-85 -75.13 -32.81 61.45 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.363 0.665 . . . . 75.21 111.337 178.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.417 ' O ' ' HG2' ' A' ' 44' ' ' MET . 45.4 mm-40 -63.58 -53.81 45.93 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.989 0.515 . . . . 75.43 111.644 177.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -62.19 -38.42 89.04 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.219 0.608 . . . . 65.34 111.29 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.458 HD21 HD23 ' A' ' 24' ' ' LEU . 38.6 tp -67.36 -37.22 82.86 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.634 0.774 . . . . 72.34 111.682 176.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -73.35 -21.5 60.52 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.175 0.59 . . . . 74.15 111.436 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' O ' ' A' ' 40' ' ' GLU . 23.0 mmt -79.25 -38.2 36.13 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.839 0.456 . . . . 53.45 110.294 170.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 12.4 mmt85 -58.05 -49.55 76.52 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 123.831 0.852 . . . . 75.31 111.377 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.43 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 75.3 p -96.29 -17.28 20.82 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.895 0.878 . . . . 72.03 113.353 -170.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 64.07 23.97 13.38 Favored 'General case' 0 N--CA 1.496 1.871 0 C-N-CA 124.279 1.032 . . . . 65.51 112.083 -170.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 98.5 mt -89.82 173.18 8.4 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.597 0.759 . . . . 54.54 111.464 174.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.1 m -100.82 156.26 17.46 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 124.096 0.958 . . . . 73.12 109.441 173.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -56.15 -23.52 35.27 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 112.66 0.615 . . . . 73.22 112.66 175.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -60.24 -52.41 65.4 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.393 0.677 . . . . 53.01 111.144 172.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -69.22 -34.69 75.24 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.17 0.588 . . . . 75.43 111.749 -179.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 61.1 t -67.23 -41.16 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.142 0 C-N-CA 123.042 0.537 . . . . 45.25 110.412 175.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 36.2 tt0 -63.67 -54.45 35.44 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 122.525 0.33 . . . . 64.54 110.807 178.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.1 t -57.08 -40.17 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 123.584 0.754 . . . . 53.52 112.107 -178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 67.5 t90 -62.93 -56.94 12.76 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 122.152 0.181 . . . . 72.33 110.572 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.606 ' HB3' HH21 ' A' ' 61' ' ' ARG . 37.5 m-85 -64.32 -35.63 81.49 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 113.294 0.85 . . . . 72.22 113.294 -177.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.41 HE21 ' NH2' ' A' ' 61' ' ' ARG . 30.4 mm-40 -66.34 -50.64 62.9 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 123.056 0.542 . . . . 74.15 110.933 177.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.401 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 21.6 t-20 -68.18 -35.78 78.56 Favored 'General case' 0 CA--C 1.554 1.115 0 CA-C-N 115.469 -0.787 . . . . 65.43 110.225 -179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 11.6 tpt180 -67.71 -37.96 82.97 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.693 0.797 . . . . 74.1 110.88 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.606 HH21 ' HB3' ' A' ' 57' ' ' PHE . 66.1 mtm180 -73.06 -28.69 62.46 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.405 0.682 . . . . 74.31 111.927 174.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.79 -30.46 69.04 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 122.817 0.447 . . . . 64.01 111.134 172.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 59' ' ' ASN . 64.2 mttm -84.07 -30.61 25.89 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.85 0.86 . . . . 62.41 111.635 173.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 64.9 t90 -65.72 -46.35 79.26 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.774 0.829 . . . . 74.3 111.337 -172.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.5 mtm180 -81.26 164.61 22.12 Favored 'General case' 0 CA--C 1.556 1.179 0 N-CA-C 109.552 -0.536 . . . . 74.32 109.552 172.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -76.83 80.19 3.42 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-O 121.676 0.75 . . . . 72.21 112.855 -170.622 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -102.51 125.34 49.2 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.656 1.183 . . . . 64.24 109.439 171.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -90.67 -58.07 2.61 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.164 0.586 . . . . 73.35 111.126 179.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.6 ttp180 -148.23 -37.15 0.19 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.203 0.601 . . . . 74.33 111.849 -172.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.4 t80 -60.6 126.44 27.45 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.621 0.769 . . . . 63.31 111.639 -178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 123.1 16.56 3.53 Favored Glycine 0 CA--C 1.533 1.158 0 CA-C-N 115.924 -0.58 . . . . 70.43 112.675 -172.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.1 tp60 -83.85 137.17 33.81 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.37 0.668 . . . . 75.12 111.904 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 23.2 ptt? -157.34 118.53 3.63 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.104 0.961 . . . . 61.45 109.488 176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -86.87 -63.8 1.25 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 120.962 0.411 . . . . 71.22 111.114 -179.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 59.0 tp60 . . . . . 0 CA--C 1.562 1.423 0 C-N-CA 123.784 0.834 . . . . 61.41 111.246 -176.307 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.486 1.327 0 CA-C-O 120.794 0.33 . . . . 54.23 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 20.7 t60 -161.47 101.05 1.19 Allowed 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 123.706 0.802 . . . . 73.41 109.461 178.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.6 ptm -104.56 114.53 28.82 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.182 0.593 . . . . 72.14 110.774 176.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 52.7 m -135.65 131.23 35.5 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.501 0.72 . . . . 74.21 110.559 179.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -77.73 160.32 28.5 Favored 'General case' 0 N--CA 1.482 1.168 0 CA-C-O 121.241 0.543 . . . . 73.22 111.592 177.303 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.85 95.49 7.9 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.78 0.832 . . . . 72.34 109.858 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -78.55 73.05 2.29 Favored Glycine 0 C--N 1.35 1.35 0 CA-C-N 116.27 -0.423 . . . . 74.45 112.709 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -115.71 151.47 35.03 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.816 0.846 . . . . 73.33 112.039 -175.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt -104.05 116.36 32.09 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.553 0.741 . . . . 73.13 110.14 177.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 35.7 ptt180 -91.63 153.77 19.48 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.435 0.694 . . . . 62.21 112.305 -175.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtm105 -81.3 109.78 16.13 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.874 0.87 . . . . 75.3 110.629 175.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -99.02 -13.49 19.86 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 122.988 0.515 . . . . 74.33 111.53 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.95 -67.73 0.97 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.593 0.757 . . . . 73.34 109.222 -179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.5 m 67.48 93.49 0.07 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 125.155 1.382 . . . . 74.42 112.217 -172.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.1 m -139.56 -54.59 0.56 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 124.625 1.17 . . . . 65.3 107.843 167.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.437 ' HE1' ' HB3' ' A' ' 52' ' ' ARG . 35.5 m-85 -115.14 141.57 47.83 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 114.389 -1.278 . . . . 71.41 108.509 170.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.5 p -76.06 170.43 16.29 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 117.689 0.222 . . . . 54.25 110.818 178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.499 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 42.6 t -54.19 -53.32 55.14 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 122.834 0.453 . . . . 74.5 111.051 176.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -56.38 -47.35 79.09 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.738 0.815 . . . . 62.31 112.451 178.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.414 ' O ' ' HG ' ' A' ' 24' ' ' LEU . 95.5 mt-30 -56.32 -47.78 78.06 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.377 0.423 . . . . 70.22 111.14 -178.421 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.9 mt -59.65 -41.13 89.85 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.375 0.67 . . . . 52.45 112.185 177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.499 ' HG2' ' O ' ' A' ' 18' ' ' SER . 9.1 mm-40 -65.7 -25.55 67.37 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 123.105 0.562 . . . . 73.24 111.999 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -82.94 -41.43 18.85 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.956 0.503 . . . . 54.55 111.084 173.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 20' ' ' GLN . 87.5 mt -61.48 -48.67 80.05 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.699 0.8 . . . . 75.33 111.549 -177.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 0.9 OUTLIER -73.75 -26.52 60.71 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.183 0.438 . . . . 71.24 112.183 179.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -61.55 -46.78 88.47 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.347 0.659 . . . . 64.12 110.926 173.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.3 t -74.79 -20.38 16.73 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.169 0 C-N-CA 123.228 0.611 . . . . 65.42 111.103 176.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -67.55 -35.12 78.44 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.784 0.433 . . . . 65.33 110.619 169.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.433 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 19.9 mm-40 -70.89 -40.55 72.15 Favored 'General case' 0 N--CA 1.491 1.583 0 CA-C-O 121.33 0.586 . . . . 73.23 110.354 175.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -61.54 -48.0 83.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.465 1.106 . . . . 63.54 111.499 175.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.6 t -156.48 121.65 4.69 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 124.43 1.092 . . . . 75.13 110.698 -177.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -74.44 -11.58 60.27 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 122.873 0.469 . . . . 64.54 111.855 178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.0 p90 -134.95 79.17 52.13 Favored Pre-proline 0 CA--C 1.566 1.561 0 C-N-CA 123.93 0.892 . . . . 64.25 110.749 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -70.09 123.86 10.4 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 122.682 2.255 . . . . 71.1 113.987 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 5.8 p-10 -79.73 -173.78 4.0 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.63 1.172 . . . . 75.22 111.622 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 40' ' ' GLU . 14.4 p -49.07 -47.25 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 123.64 0.776 . . . . 72.12 113.062 -177.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -69.32 -42.42 75.4 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.597 0.759 . . . . 71.43 111.246 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.84 -27.33 65.74 Favored 'General case' 0 CA--C 1.556 1.192 0 CA-C-N 116.001 -0.545 . . . . 61.13 111.76 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.749 HH11 HG12 ' A' ' 53' ' ' VAL . 36.9 mmt180 -73.84 -42.94 60.14 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.372 0.669 . . . . 72.31 110.851 174.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.403 ' HG3' ' O ' ' A' ' 36' ' ' VAL . 42.4 mt-10 -60.79 -51.21 70.28 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.67 0.788 . . . . 75.42 111.548 -179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 45' ' ' ARG . 17.7 mm-40 -59.82 -50.93 71.88 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.716 -0.674 . . . . 65.32 111.195 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 29.0 tp -62.73 -35.18 78.94 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.592 0.757 . . . . 63.14 112.264 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.56 -43.78 96.07 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.18 0.592 . . . . 53.43 111.182 177.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.1 mtt -71.39 -30.27 65.91 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.408 0.683 . . . . 75.45 111.768 178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 21.3 mmt85 -66.36 -44.35 83.46 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 122.976 0.51 . . . . 71.33 110.888 174.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.7 p -93.83 -14.17 26.45 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 114.137 1.162 . . . . 73.43 114.137 -171.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.7 t70 74.02 4.47 4.61 Favored 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 124.389 1.076 . . . . 74.14 111.635 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.2 mt -85.71 164.35 17.69 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 121.682 0.753 . . . . 72.24 112.271 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.4 m -91.11 151.3 21.05 Favored 'General case' 0 N--CA 1.474 0.774 0 CA-C-N 114.933 -1.03 . . . . 70.11 109.902 171.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.441 ' HG2' ' HB3' ' A' ' 39' ' ' ARG . 7.2 tm-20 -52.75 -36.82 58.43 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.477 0.711 . . . . 72.22 111.334 -179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.53 -50.16 72.66 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.543 0.737 . . . . 52.22 112.525 175.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.437 ' HB3' ' HE1' ' A' ' 16' ' ' PHE . 4.9 mpt_? -64.19 -41.7 96.97 Favored 'General case' 0 N--CA 1.494 1.725 0 C-N-CA 122.991 0.516 . . . . 74.01 111.242 179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.749 HG12 HH11 ' A' ' 39' ' ' ARG . 60.2 t -64.15 -37.17 79.17 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.564 0.746 . . . . 64.31 110.884 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -52.73 53.22 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 124.207 1.003 . . . . 64.13 109.853 -177.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 99.2 t -58.06 -39.89 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 O-C-N 124.056 0.847 . . . . 71.53 111.685 179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -56.84 -51.68 68.05 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.452 0.301 . . . . 75.33 110.911 177.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -64.86 -28.34 69.48 Favored 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.042 0.537 . . . . 71.31 112.301 178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.5 mm-40 -63.66 -49.92 71.29 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 118.489 0.586 . . . . 73.02 111.271 174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.5 m-80 -65.62 -39.75 91.85 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 122.895 0.478 . . . . 72.22 111.499 177.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 27.6 tpt180 -64.5 -45.53 86.87 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.511 0.725 . . . . 73.01 111.763 -176.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -75.38 -26.76 58.74 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 123.136 0.574 . . . . 73.4 111.843 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.33 -38.44 84.91 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.027 0.531 . . . . 63.54 111.317 173.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -73.75 -25.77 60.33 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.582 0.753 . . . . 74.42 111.466 174.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -70.89 -49.16 48.94 Favored 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 123.207 0.603 . . . . 73.2 110.735 175.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 30.3 mtm-85 -71.06 115.87 10.7 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.371 0.669 . . . . 73.43 111.053 178.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 62.6 mttp -71.49 123.79 23.2 Favored 'General case' 0 CA--C 1.56 1.331 0 C-N-CA 123.192 0.597 . . . . 73.13 112.446 -174.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.49 25.21 14.83 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 125.617 1.567 . . . . 75.12 113.07 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -74.46 155.76 37.67 Favored 'General case' 0 CA--C 1.561 1.385 0 C-N-CA 123.584 0.754 . . . . 71.1 110.588 177.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.7 ttm180 73.58 118.35 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.888 0 C-N-CA 125.299 1.44 . . . . 71.13 111.317 -172.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 28.1 p90 -135.27 152.92 51.96 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.705 0.802 . . . . 51.41 110.918 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -78.9 73.08 2.35 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 116.357 -0.383 . . . . 62.52 114.037 -175.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -91.38 115.25 27.88 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.498 0.719 . . . . 75.04 110.593 176.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -153.58 67.32 0.76 Allowed 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 108.351 -0.981 . . . . 70.45 108.351 171.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -99.86 97.52 8.41 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.966 0.906 . . . . 64.01 110.401 -178.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 . . . . . 0 C--O 1.258 1.521 0 C-N-CA 123.397 0.679 . . . . 74.45 109.801 175.45 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 81.1 p . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 119.934 -0.079 . . . . 74.21 111.135 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -164.35 -29.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.362 0.665 . . . . 73.25 111.601 179.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -64.61 140.7 58.89 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.105 0.562 . . . . 72.1 111.919 -177.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 22.4 m -93.77 -38.52 11.23 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.685 0.794 . . . . 64.3 111.086 177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.6 t30 63.73 100.27 0.03 OUTLIER 'General case' 0 CA--C 1.562 1.416 0 C-N-CA 124.65 1.18 . . . . 74.24 112.289 176.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.93 90.28 1.93 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.475 0.71 . . . . 74.42 109.22 177.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 133.49 72.68 0.09 OUTLIER Glycine 0 N--CA 1.471 1.002 0 CA-C-N 115.716 -0.675 . . . . 72.13 111.531 -177.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -55.67 -52.4 63.97 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.245 1.018 . . . . 74.4 111.534 -175.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt 60.97 93.45 0.04 OUTLIER 'General case' 0 CA--C 1.559 1.309 0 C-N-CA 124.322 1.049 . . . . 74.4 111.75 -179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.5 ptt180 -67.59 -16.11 64.01 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 124.646 1.179 . . . . 75.12 113.721 -173.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.8 ttt180 -70.22 -77.66 0.08 Allowed 'General case' 0 CA--C 1.562 1.435 0 C-N-CA 123.455 0.702 . . . . 74.11 112.855 -170.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 51.9 t30 -92.16 138.74 31.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.357 0.663 . . . . 54.4 111.25 -174.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -85.07 74.0 10.57 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.611 0.765 . . . . 74.4 110.436 173.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 52.3 m -70.75 87.91 0.7 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.835 0.854 . . . . 75.55 109.737 176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 10.1 t -109.56 18.4 20.36 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.28 1.032 . . . . 74.5 111.009 -176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 38.3 m-85 -75.8 124.52 27.44 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.526 0.73 . . . . 75.34 110.913 -175.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 40.4 p -74.03 -84.84 0.04 OUTLIER 'General case' 0 CA--C 1.56 1.341 0 C-N-CA 123.632 0.773 . . . . 65.41 111.995 -176.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 97.7 p -156.18 -50.96 0.08 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.407 0.683 . . . . 63.34 109.564 177.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 t80 -64.26 -31.32 72.48 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 123.48 0.712 . . . . 71.51 111.02 174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -58.51 -52.0 67.51 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.249 0.22 . . . . 73.14 110.691 173.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 76.8 mt -68.47 -28.64 67.21 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.554 0.576 . . . . 64.11 112.554 177.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.449 ' O ' ' HB2' ' A' ' 26' ' ' LYS . 40.2 mm-40 -57.45 -54.89 41.69 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.091 0.556 . . . . 75.02 110.695 172.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -68.21 -45.7 72.63 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 123.354 0.661 . . . . 71.32 112.67 -178.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.489 HD23 HD21 ' A' ' 42' ' ' LEU . 80.2 mt -55.78 -52.21 64.75 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 123.459 0.704 . . . . 72.41 111.57 179.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.527 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 65.3 mm-40 -63.64 -43.22 97.41 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.304 0.642 . . . . 61.45 111.878 175.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.449 ' HB2' ' O ' ' A' ' 22' ' ' GLU . 28.5 ttmt -64.43 -39.06 93.11 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 123.684 0.793 . . . . 75.22 111.615 -174.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 74.6 t -69.03 -36.92 76.11 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.049 0 C-N-CA 123.746 0.818 . . . . 73.23 110.529 172.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -67.43 -36.95 82.24 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.258 0.623 . . . . 50.34 111.94 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.527 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 74.1 mm-40 -74.65 -30.77 61.73 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.017 0.527 . . . . 74.41 110.446 177.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -74.07 -39.38 63.5 Favored 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.753 0.821 . . . . 75.34 110.988 177.551 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.8 t -161.83 138.72 8.34 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.726 1.211 . . . . 53.34 110.796 -178.176 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 43.5 m80 -76.61 -11.19 59.82 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 122.825 0.45 . . . . 52.15 111.747 177.538 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 66.8 m-85 -124.28 101.84 34.24 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 123.679 0.792 . . . . 73.33 110.966 -178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -77.87 92.96 1.1 Allowed 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.464 2.11 . . . . 73.51 110.839 169.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -70.91 179.41 2.71 Favored 'General case' 0 CA--C 1.567 1.615 0 CA-C-N 116.065 -0.516 . . . . 75.55 111.448 -176.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 11.5 p -48.89 -37.57 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 N-CA-C 114.732 1.382 . . . . 63.14 114.732 -170.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -77.46 -40.1 44.35 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 122.838 0.455 . . . . 74.13 110.942 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.89 -23.42 66.0 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.557 0.743 . . . . 70.4 111.878 175.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 29.6 mmt85 -64.17 -44.9 90.64 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.175 0.59 . . . . 64.53 110.253 171.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -63.27 -51.22 67.05 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.537 0.735 . . . . 43.4 111.692 178.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -57.99 -57.28 13.5 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.433 0.693 . . . . 74.45 111.301 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.489 HD21 HD23 ' A' ' 24' ' ' LEU . 31.3 tp -61.97 -39.34 91.83 Favored 'General case' 0 CA--C 1.554 1.11 0 C-N-CA 123.587 0.755 . . . . 75.51 112.128 -176.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.7 -48.48 81.51 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.111 0.564 . . . . 65.13 112.317 176.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.33 -25.87 62.59 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 122.971 0.509 . . . . 55.23 112.36 -177.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 25.0 mmt85 -73.04 -52.69 13.39 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 123.407 0.683 . . . . 72.13 111.52 175.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.3 p -93.1 -12.45 30.45 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 113.841 1.052 . . . . 73.45 113.841 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 67.93 16.9 9.63 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 124.51 1.124 . . . . 72.42 112.676 -171.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 97.0 mt -88.75 143.81 26.67 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.37 0.668 . . . . 60.15 110.764 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -74.65 167.22 22.2 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.432 0.293 . . . . 72.33 110.742 172.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -56.64 -38.43 72.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.693 0.397 . . . . 73.35 110.966 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.68 -43.34 80.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.877 0.871 . . . . 62.2 112.23 176.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.8 mpt_? -68.68 -37.48 79.6 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 122.989 0.516 . . . . 74.21 111.742 177.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.475 HG13 HD23 ' A' ' 42' ' ' LEU . 86.1 t -63.95 -40.92 90.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 123.283 0.633 . . . . 64.31 110.565 174.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -66.19 -58.48 5.31 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.225 0.61 . . . . 71.42 111.118 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 80.2 t -55.15 -48.65 75.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 123.623 0.769 . . . . 71.32 112.057 -178.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 75.8 t90 -55.75 -51.04 68.75 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.417 0.287 . . . . 74.4 110.55 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -68.66 -27.43 65.98 Favored 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.03 0.752 . . . . 72.31 113.03 179.41 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -68.26 -53.12 26.81 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 118.751 0.705 . . . . 74.31 110.733 176.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -63.16 -38.36 90.88 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.405 0.682 . . . . 75.32 111.41 175.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 tpt85 -65.52 -49.87 67.35 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.661 0.785 . . . . 73.4 111.931 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.9 mtm180 -66.7 -32.6 74.01 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.291 0.636 . . . . 72.54 111.959 178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.68 -48.04 78.76 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 122.996 0.519 . . . . 65.01 110.696 175.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -67.41 -31.66 72.02 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.802 0.841 . . . . 75.54 112.202 174.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 86.1 t90 -68.77 -36.36 78.23 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.928 0.891 . . . . 74.11 110.861 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 25.6 mmm180 -69.42 -52.69 24.46 Favored 'General case' 0 CA--C 1.548 0.884 0 CA-C-N 116.256 -0.429 . . . . 74.41 110.1 170.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 tptt -164.96 -61.86 0.03 OUTLIER 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 115.973 -0.558 . . . . 63.44 111.04 179.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.6 ptt180 -161.72 164.42 29.06 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 123.54 0.736 . . . . 64.31 111.52 -171.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -109.1 -26.62 10.05 Favored 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 114.298 1.222 . . . . 75.03 114.298 -169.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.8 ttp180 -65.82 -27.17 68.05 Favored 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 113.081 0.771 . . . . 60.44 113.081 -170.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -78.38 1.51 21.76 Favored 'General case' 0 CA--C 1.56 1.356 0 C-N-CA 123.486 0.714 . . . . 73.34 112.244 179.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -64.18 110.52 3.49 Favored Glycine 0 C--N 1.358 1.787 0 C-N-CA 122.916 0.293 . . . . 51.21 113.24 176.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -74.16 134.95 42.82 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.545 0.738 . . . . 63.01 112.595 -170.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.6 ptt? -143.19 155.42 44.54 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.693 0.797 . . . . 75.4 111.057 179.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 22.9 mp0 -89.97 110.22 21.21 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.003 0.521 . . . . 54.23 110.107 176.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 . . . . . 0 CA--C 1.574 1.88 0 C-N-CA 124.999 1.319 . . . . 65.3 112.675 179.357 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 N--CA 1.491 1.608 0 N-CA-C 110.406 -0.22 . . . . 75.0 110.406 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 26.1 p80 -62.46 145.98 52.73 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 122.988 0.515 . . . . 75.11 111.837 176.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.45 116.9 13.73 Favored 'General case' 0 N--CA 1.481 1.079 0 N-CA-C 108.837 -0.801 . . . . 61.14 108.837 173.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.5 p -106.66 135.03 48.89 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 124.139 0.976 . . . . 73.44 110.378 -178.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -117.79 122.07 42.46 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.644 0.778 . . . . 73.15 110.555 178.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -77.01 78.67 3.55 Favored 'General case' 0 N--CA 1.483 1.193 0 CA-C-O 121.374 0.607 . . . . 74.34 110.513 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 176.39 177.39 45.35 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 115.635 -0.711 . . . . 21.03 112.866 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt 59.27 29.06 18.56 Favored 'General case' 0 N--CA 1.497 1.925 0 C-N-CA 124.037 0.935 . . . . 75.01 111.925 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 54.8 mtpt -77.96 17.72 0.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.509 1.124 . . . . 61.53 113.699 -172.011 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.2 ttt180 -76.92 -9.59 58.79 Favored 'General case' 0 CA--C 1.557 1.233 0 C-N-CA 122.947 0.499 . . . . 64.13 110.758 176.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.1 mmt180 -84.76 87.52 7.31 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.563 0.745 . . . . 72.0 111.404 170.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -100.3 119.9 39.11 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.592 0.757 . . . . 75.01 109.281 176.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 48.3 ttt-85 -124.56 135.75 53.41 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.186 0.594 . . . . 63.24 110.268 177.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 74.7 p -87.92 61.15 6.23 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.769 0.828 . . . . 74.5 111.562 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 35.7 m -77.22 84.0 3.69 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.415 0.686 . . . . 61.24 109.722 177.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 64.1 m-85 62.06 -179.83 0.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 124.749 1.219 . . . . 70.31 112.235 -175.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 82.6 p -131.57 -177.77 4.56 Favored 'General case' 0 N--CA 1.498 1.934 0 C-N-CA 123.252 0.621 . . . . 53.25 110.325 167.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 37.1 t -54.96 -51.95 64.56 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.051 0.94 . . . . 63.42 113.241 -176.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -53.85 -42.79 68.92 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.96 0.904 . . . . 74.5 111.994 -178.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 12.1 mp0 -59.27 -58.68 7.55 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.178 -0.919 . . . . 72.44 110.781 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 73.0 mt -64.27 -27.5 69.09 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.237 0.615 . . . . 74.53 112.605 -174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -67.83 -47.07 70.04 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.211 0.604 . . . . 64.43 111.345 175.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 66.0 mm-40 -74.39 -40.2 62.19 Favored 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 112.791 0.663 . . . . 73.34 112.791 179.588 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.77 -45.16 90.42 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.677 0.791 . . . . 74.42 110.748 176.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.486 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -64.29 -44.69 90.86 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.539 0.735 . . . . 65.01 111.859 171.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.433 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 56.2 tttp -54.59 -46.44 73.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.054 0.542 . . . . 61.44 111.46 -177.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 45.0 t -75.86 -32.52 23.96 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 123.398 0.679 . . . . 72.15 111.822 179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -64.47 -32.2 73.72 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.442 0.697 . . . . 75.5 111.289 176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 77.5 mm-40 -85.49 -20.98 28.88 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.327 0.651 . . . . 71.02 111.59 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.433 ' HG3' ' O ' ' A' ' 26' ' ' LYS . 96.4 mttt -65.13 -55.09 20.72 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.667 0.746 . . . . 72.05 109.033 167.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.9 t -156.31 135.62 12.19 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.416 -1.265 . . . . 62.42 110.279 -178.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 49.9 m80 -71.47 -18.3 62.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.306 0.642 . . . . 64.54 112.052 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 4.5 p90 -130.08 76.65 77.71 Favored Pre-proline 0 CA--C 1.559 1.323 0 C-N-CA 124.789 1.236 . . . . 71.34 110.242 176.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.464 ' HB2' ' HG3' ' A' ' 39' ' ' ARG . 19.8 Cg_exo -67.33 139.85 51.16 Favored 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 122.321 2.014 . . . . 74.43 112.674 178.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.02 170.11 4.7 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 122.952 0.501 . . . . 74.33 111.607 173.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 4.9 p -50.98 -47.77 30.04 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.208 0 CA-C-N 115.764 -0.653 . . . . 74.41 112.06 179.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 14.5 t80 -64.05 -42.59 96.97 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.975 0.91 . . . . 71.53 111.858 -173.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.37 93.56 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 123.341 0.656 . . . . 73.23 111.847 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.464 ' HG3' ' HB2' ' A' ' 34' ' ' PRO . 59.3 mtm180 -78.04 -20.37 52.54 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.696 0.798 . . . . 72.51 112.406 179.308 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 27.7 mm-40 -69.72 -47.67 62.29 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 120.845 0.355 . . . . 73.21 110.38 170.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -56.7 -48.94 76.57 Favored 'General case' 0 N--CA 1.485 1.317 0 CA-C-N 115.534 -0.757 . . . . 71.22 110.763 174.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 40.1 tp -61.18 -46.58 89.93 Favored 'General case' 0 CA--C 1.556 1.207 0 C-N-CA 124.248 1.019 . . . . 75.02 112.149 179.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.26 -31.99 73.42 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.381 0.672 . . . . 44.41 112.538 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 89.4 mtp -75.64 -46.02 33.94 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.91 0.484 . . . . 75.01 111.643 176.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 95.4 mtt180 -56.62 -55.82 29.21 Favored 'General case' 0 N--CA 1.494 1.739 0 C-N-CA 123.496 0.718 . . . . 75.35 111.048 178.087 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.8 p -75.25 -13.67 60.46 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 115.487 -0.779 . . . . 72.44 111.995 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 33.5 t70 63.07 17.42 10.13 Favored 'General case' 0 CA--C 1.567 1.628 0 C-N-CA 124.282 1.033 . . . . 73.43 111.612 -179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.1 mt -86.9 157.34 19.54 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.534 0.734 . . . . 71.45 110.299 179.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 37.6 m -67.08 142.85 57.0 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 108.996 -0.742 . . . . 74.11 108.996 167.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -65.34 -35.87 82.29 Favored 'General case' 0 CA--C 1.554 1.104 0 N-CA-C 110.089 -0.337 . . . . 70.22 110.089 -178.222 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.82 -34.68 73.4 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.278 0.631 . . . . 34.53 112.236 173.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.9 ttt180 -72.49 -37.53 68.41 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.681 0.793 . . . . 73.42 111.051 176.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.6 t -60.54 -40.71 85.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.671 0.788 . . . . 62.3 110.431 171.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 31.6 mm-40 -59.41 -37.74 78.8 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.797 0.839 . . . . 74.34 112.092 175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 56.2 t -62.38 -44.05 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 C-N-CA 122.62 0.368 . . . . 60.1 111.252 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 70.3 t90 -62.44 -47.88 82.13 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.362 0.665 . . . . 63.45 110.567 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -66.41 -38.35 87.27 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.554 0.741 . . . . 74.32 112.361 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -66.88 -40.52 87.82 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 118.817 0.735 . . . . 54.23 111.326 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -57.57 -43.89 84.9 Favored 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 123.767 0.827 . . . . 75.53 109.553 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 -64.16 -54.56 31.86 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 114.875 -1.057 . . . . 73.25 112.156 174.151 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -61.35 -27.28 68.39 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 124.351 1.06 . . . . 71.43 112.321 -174.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.67 -46.27 90.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.111 0.564 . . . . 63.54 111.34 176.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -83.78 -31.56 25.84 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 123.988 0.915 . . . . 74.03 111.937 179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 89.8 t90 -71.54 -34.69 70.25 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.525 1.13 . . . . 63.45 111.363 -179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.03 -34.57 77.85 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.812 0.845 . . . . 65.03 111.893 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -146.05 93.5 2.34 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.143 0.577 . . . . 74.34 110.488 -179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 39.2 ttm-85 -93.76 126.29 38.86 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.062 0.545 . . . . 74.22 110.512 176.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -159.66 -170.52 2.94 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.85 0.86 . . . . 71.31 110.69 179.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -75.87 177.76 6.72 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.32 0.648 . . . . 71.04 111.626 176.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -66.96 -43.71 82.4 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 122.46 0.304 . . . . 74.25 111.575 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 90.54 136.49 6.59 Favored Glycine 0 CA--C 1.536 1.404 0 CA-C-N 116.142 -0.481 . . . . 72.44 113.089 -179.429 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.61 83.47 1.29 Allowed 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 108.742 -0.836 . . . . 63.33 108.742 177.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 ttm -157.14 -53.98 0.08 Allowed 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.024 0.929 . . . . 72.34 109.699 178.133 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 20.4 tp60 -142.6 80.91 1.72 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 121.658 0.742 . . . . 71.31 109.682 174.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 . . . . . 0 CA--C 1.566 1.579 0 CA-C-N 115.167 -0.924 . . . . 72.5 108.972 172.464 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 86.6 p . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.669 0.271 . . . . 55.24 111.616 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.2 160.03 39.68 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.468 0.707 . . . . 75.53 111.507 -178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 51.2 tpp -152.72 150.87 29.88 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 122.976 0.511 . . . . 63.21 111.427 -176.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 89.3 p -88.21 -173.12 4.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 124.165 0.986 . . . . 70.44 112.204 178.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 51.8 m-80 -62.99 110.95 1.96 Allowed 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 122.834 0.454 . . . . 65.32 110.712 171.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 47.2 mtmt -83.32 60.14 5.42 Favored 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 124.18 0.992 . . . . 72.43 112.102 -173.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 71.42 -73.28 0.75 Allowed Glycine 0 CA--C 1.537 1.456 0 N-CA-C 114.045 0.378 . . . . 51.52 114.045 178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.439 ' NZ ' ' HB2' ' A' ' 8' ' ' LYS . 8.6 mtmp? 68.32 82.1 0.18 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 125.088 1.355 . . . . 74.53 111.583 179.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -155.1 22.17 0.43 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.405 0.682 . . . . 74.43 111.26 178.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 32.7 mtp-105 -92.7 120.32 32.98 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.537 0.735 . . . . 74.43 111.709 -177.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 15.3 ptt180 -86.6 135.81 33.29 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.852 0.461 . . . . 75.13 110.791 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -85.0 172.14 11.54 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.378 0.671 . . . . 75.13 112.313 -175.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -158.09 66.87 0.47 Allowed 'General case' 0 CA--C 1.557 1.237 0 CA-C-O 121.56 0.695 . . . . 72.32 112.375 -173.065 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.3 p -134.66 75.1 1.56 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.709 -0.619 . . . . 75.13 111.327 178.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.4 m -77.41 -58.64 3.16 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.26 0.624 . . . . 63.12 110.927 176.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 66.16 153.85 0.08 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 125.257 1.423 . . . . 60.43 112.899 -176.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 27.1 p -101.96 -178.26 3.66 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.236 0.614 . . . . 63.53 111.332 178.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 40.6 t -62.0 -51.34 68.43 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.508 0.723 . . . . 44.22 111.663 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.3 t80 -61.62 -38.32 87.18 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.25 0.62 . . . . 75.41 111.405 177.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.624 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 80.6 mt-30 -62.27 -50.38 71.94 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 122.804 0.442 . . . . 75.51 112.093 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.43 HD23 HD12 ' A' ' 24' ' ' LEU . 82.9 mt -70.51 -29.06 65.46 Favored 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 112.004 0.372 . . . . 71.54 112.004 178.663 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.63 -44.25 96.59 Favored 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.769 0.828 . . . . 75.15 110.246 174.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -74.7 -48.72 24.38 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.744 0.818 . . . . 72.1 112.531 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.539 HD23 HD21 ' A' ' 42' ' ' LEU . 70.7 mt -54.72 -51.55 65.24 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 123.913 0.885 . . . . 70.44 111.575 -177.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 16.7 mm-40 -62.87 -42.52 99.79 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.155 0.582 . . . . 71.15 112.056 175.718 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 38.0 ttmt -57.95 -40.47 80.61 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.193 0.597 . . . . 62.33 111.527 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 96.1 t -72.17 -40.17 65.83 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.034 0 C-N-CA 123.679 0.792 . . . . 74.35 111.051 176.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -66.11 -40.88 91.06 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.449 0.7 . . . . 71.44 112.397 -177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 73.3 mm-40 -76.52 -12.59 60.05 Favored 'General case' 0 CA--C 1.559 1.289 0 N-CA-C 112.324 0.49 . . . . 74.21 112.324 -176.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -96.98 -45.55 6.55 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.415 0.686 . . . . 64.2 110.438 173.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.5 t -138.82 119.23 13.78 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 124.125 0.97 . . . . 73.42 110.207 173.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 54.3 m80 -73.64 -15.99 61.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.041 0.536 . . . . 75.41 111.835 -178.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 6.9 p90 -132.74 77.9 67.87 Favored Pre-proline 0 CA--C 1.569 1.694 0 C-N-CA 124.325 1.05 . . . . 75.41 111.192 179.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.418 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 60.7 Cg_endo -72.48 135.23 23.9 Favored 'Trans proline' 0 C--N 1.379 2.149 0 C-N-CA 122.513 2.142 . . . . 64.45 113.739 178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.406 ' O ' ' HG2' ' A' ' 39' ' ' ARG . 12.9 m-20 -82.8 178.47 8.17 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.813 0.845 . . . . 71.02 112.512 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 13.3 p -51.71 -41.96 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 N-CA-C 114.253 1.205 . . . . 75.54 114.253 -171.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 52.9 t80 -70.56 -38.56 74.13 Favored 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 122.865 0.466 . . . . 71.2 111.106 -177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.96 -32.55 74.33 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 115.902 -0.59 . . . . 51.22 111.184 172.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.418 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 15.9 mmt85 -72.42 -31.77 65.77 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.443 0.697 . . . . 63.34 111.231 176.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.41 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 41.9 mm-40 -60.92 -57.95 10.5 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 122.587 0.355 . . . . 75.41 110.21 175.357 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -58.55 -46.52 86.67 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.444 0.698 . . . . 65.42 111.966 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.539 HD21 HD23 ' A' ' 24' ' ' LEU . 35.2 tp -59.32 -56.33 23.51 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.665 0.786 . . . . 73.14 111.425 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.03 -33.51 76.23 Favored 'General case' 0 N--CA 1.487 1.383 0 N-CA-C 113.179 0.807 . . . . 60.12 113.179 -175.774 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.9 mtt -68.91 -43.62 74.83 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 112.058 0.392 . . . . 71.24 112.058 179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -67.12 -45.39 77.31 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.29 0.567 . . . . 60.42 111.251 177.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.624 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 69.9 p -85.53 -6.54 59.17 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 113.357 0.873 . . . . 41.43 113.357 -173.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 61.49 28.74 17.98 Favored 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.443 1.097 . . . . 74.33 112.421 -176.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.401 HD22 ' HD3' ' A' ' 52' ' ' ARG . 94.8 mt -94.95 168.24 10.9 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.528 0.731 . . . . 74.12 112.139 179.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 86.6 m -110.07 147.1 34.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.034 0.934 . . . . 75.41 109.182 172.19 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -42.31 -45.51 4.26 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.661 1.184 . . . . 73.23 113.661 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.418 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -65.97 -39.31 90.27 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 112.623 0.601 . . . . 72.41 112.623 -178.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.401 ' HD3' HD22 ' A' ' 48' ' ' LEU . 31.2 ttt180 -73.56 -35.89 65.55 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.926 0.49 . . . . 54.41 110.939 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 93.2 t -60.38 -43.89 94.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 123.69 0.796 . . . . 63.54 109.939 171.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 8.3 mm100 -56.42 -49.89 73.22 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.367 -0.833 . . . . 74.43 112.468 177.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 51' ' ' ALA . 59.5 t -51.79 -46.18 39.27 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.802 0 C-N-CA 123.057 0.543 . . . . 74.14 111.843 -178.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 71.9 t90 -58.92 -48.67 80.65 Favored 'General case' 0 CA--C 1.556 1.21 0 CA-C-N 115.644 -0.707 . . . . 72.3 110.778 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 m-85 -70.27 -21.1 63.0 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.502 0.721 . . . . 71.2 112.904 177.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.433 HE22 ' NH2' ' A' ' 61' ' ' ARG . 26.5 mm-40 -67.39 -49.68 62.85 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 118.826 0.739 . . . . 72.23 109.951 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 43.4 m-80 -67.09 -36.91 83.0 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 122.888 0.475 . . . . 72.42 111.167 176.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.67 -46.08 83.94 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.637 0.775 . . . . 62.21 111.886 -176.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.433 ' NH2' HE22 ' A' ' 58' ' ' GLN . 78.5 mtm180 -81.37 -23.52 37.62 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.951 0.5 . . . . 73.41 111.875 -179.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -42.94 86.95 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 120.921 0.391 . . . . 32.44 110.559 172.064 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt -72.63 -30.24 64.16 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.715 0.806 . . . . 72.55 111.875 174.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.1 t90 -62.2 -36.86 83.23 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.284 0.634 . . . . 61.11 110.485 173.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -88.17 167.4 13.64 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.432 0.693 . . . . 75.31 111.283 172.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.483 ' HG3' ' HG3' ' A' ' 67' ' ' ARG . 0.0 OUTLIER -83.63 -15.21 49.86 Favored 'General case' 0 N--CA 1.489 1.516 0 N-CA-C 114.082 1.141 . . . . 71.55 114.082 -172.136 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.483 ' HG3' ' HG3' ' A' ' 66' ' ' LYS . 99.5 mtt180 -123.76 133.86 53.76 Favored 'General case' 0 N--CA 1.49 1.528 0 N-CA-C 112.392 0.515 . . . . 75.24 112.392 -175.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -85.72 -49.46 7.94 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 124.465 1.106 . . . . 73.31 108.874 170.011 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 6.8 mpt_? -98.0 122.9 41.69 Favored 'General case' 0 CA--C 1.55 0.944 0 CA-C-N 114.869 -1.059 . . . . 74.25 108.306 170.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 74.2 t80 -58.46 -47.21 84.77 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 112.875 0.694 . . . . 72.3 112.875 -175.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 172.04 83.15 0.05 OUTLIER Glycine 0 CA--C 1.529 0.909 0 CA-C-N 116.593 -0.276 . . . . 70.34 112.462 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 27.7 pt20 -148.85 157.42 43.42 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.185 0.594 . . . . 74.01 111.56 -176.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.9 ttt -143.65 138.08 28.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.719 0.808 . . . . 64.33 110.411 174.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 21.9 tt0 -147.34 34.38 0.88 Allowed 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.855 0.862 . . . . 70.33 109.269 175.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 8.2 mp0 . . . . . 0 CA--C 1.576 1.977 0 C-N-CA 125.199 1.399 . . . . 73.3 112.877 -179.405 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 89.7 p . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 120.453 0.168 . . . . 73.24 111.188 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 11.2 p80 -151.73 143.85 23.93 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 123.034 0.534 . . . . 73.21 111.132 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -76.23 117.19 17.66 Favored 'General case' 0 CA--C 1.559 1.321 0 C-N-CA 123.102 0.561 . . . . 72.51 111.03 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.2 t -170.86 172.61 5.54 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.958 0.903 . . . . 72.4 110.59 -175.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -75.7 95.79 3.48 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.855 0.462 . . . . 73.1 109.78 174.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -124.07 61.38 1.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.078 0.951 . . . . 74.34 111.914 -172.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -88.67 62.99 3.63 Favored Glycine 0 N--CA 1.477 1.38 0 CA-C-N 115.71 -0.677 . . . . 44.31 112.465 177.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -85.49 100.29 11.79 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.341 0.656 . . . . 72.21 111.408 -175.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 19.7 pttp -137.8 104.3 5.25 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.316 0.646 . . . . 73.22 111.212 176.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 62.98 123.07 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 125.599 1.56 . . . . 62.21 113.759 176.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -80.5 100.8 8.72 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 123.36 0.664 . . . . 72.44 112.239 -176.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.403 ' N ' HD22 ' A' ' 12' ' ' ASN . 0.8 OUTLIER -102.86 -80.15 0.52 Allowed 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.235 -1.024 . . . . 61.41 108.235 165.515 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.0 mtt-85 -135.84 50.94 2.07 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.571 1.148 . . . . 73.02 109.186 171.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.6 t -93.34 79.59 4.42 Favored 'General case' 0 N--CA 1.485 1.298 0 CA-C-O 121.938 0.875 . . . . 73.22 110.871 -177.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.4 p -116.76 -60.52 1.84 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.138 0.975 . . . . 72.41 111.324 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -122.99 129.88 52.09 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.482 0.713 . . . . 75.43 111.529 -177.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.3 p -73.87 173.24 10.2 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.998 0.519 . . . . 62.14 111.302 178.376 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 68.3 m -61.36 -52.11 66.0 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.281 0.632 . . . . 53.53 111.731 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.52 -46.24 77.03 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.787 0.835 . . . . 71.3 111.516 174.385 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.643 ' HG3' ' HB ' ' A' ' 46' ' ' THR . 50.6 tt0 -58.16 -45.27 87.75 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.925 -1.034 . . . . 70.04 111.248 -177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.2 mt -65.19 -32.73 74.56 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.447 0.699 . . . . 72.33 112.802 176.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 -66.26 -40.26 90.02 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 111.954 0.353 . . . . 72.14 111.954 178.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.4 mm-40 -70.53 -43.38 69.72 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.894 0.477 . . . . 63.12 111.311 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 69.1 mt -59.29 -47.27 86.0 Favored 'General case' 0 CA--C 1.559 1.306 0 C-N-CA 123.569 0.748 . . . . 63.42 111.128 176.44 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 4.5 mm-40 -62.75 -36.95 84.72 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 124.332 1.053 . . . . 72.12 112.47 174.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -54.35 -43.7 71.5 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.951 0.9 . . . . 63.34 111.816 178.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 60.1 t -78.19 -32.57 17.14 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 123.435 0.694 . . . . 71.33 111.262 178.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -65.98 -37.58 86.34 Favored 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 123.505 0.722 . . . . 73.55 112.018 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 85.6 mm-40 -78.53 -15.11 58.95 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.303 0.641 . . . . 71.35 112.077 -177.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -85.59 -48.48 8.86 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.402 0.681 . . . . 72.02 110.325 167.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 8.0 t -150.93 132.61 14.89 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.79 0.836 . . . . 72.03 111.007 -179.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -76.79 -12.74 60.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.452 0.701 . . . . 62.5 111.148 177.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -121.9 92.1 48.79 Favored Pre-proline 0 CA--C 1.554 1.121 0 C-N-CA 124.684 1.194 . . . . 72.51 109.513 177.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HG2' ' HE ' ' A' ' 39' ' ' ARG . 69.1 Cg_endo -69.6 137.75 36.69 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 122.559 2.173 . . . . 72.13 112.924 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.56 159.24 22.16 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 124.095 0.958 . . . . 72.52 110.848 174.277 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 10.9 p -58.78 -41.9 83.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 CA-C-N 118.108 0.413 . . . . 62.5 111.417 -179.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -67.62 -40.54 84.68 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.141 0.976 . . . . 73.31 110.365 177.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.75 -35.05 78.54 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.413 0.685 . . . . 75.13 112.207 178.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.409 ' HE ' ' HG2' ' A' ' 34' ' ' PRO . 98.6 mtt180 -68.61 -40.15 80.54 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.575 0.75 . . . . 73.14 111.385 178.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.95 -49.37 68.14 Favored 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.764 0.825 . . . . 73.31 111.725 178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.0 mm-40 -66.35 -33.51 75.89 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.298 0.639 . . . . 62.43 111.848 179.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.6 tp -70.9 -37.93 72.98 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.081 0.552 . . . . 62.35 110.964 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.61 -33.16 72.34 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.066 0.547 . . . . 63.3 111.352 173.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 87.9 mtp -69.98 -35.82 74.71 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 123.482 0.713 . . . . 53.54 111.614 173.661 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 26.7 mmt85 -66.53 -37.49 85.12 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.043 0.537 . . . . 74.12 111.671 176.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.643 ' HB ' ' HG3' ' A' ' 20' ' ' GLN . 77.2 p -114.06 4.34 15.63 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 114.24 1.2 . . . . 64.55 114.24 -165.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 64.09 14.78 8.8 Favored 'General case' 0 N--CA 1.498 1.964 0 C-N-CA 124.013 0.925 . . . . 71.34 112.979 -177.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.424 ' HG ' HE21 ' A' ' 20' ' ' GLN . 80.6 mt -87.07 178.14 7.0 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-O 122.076 0.941 . . . . 71.41 112.079 -178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 m -108.97 156.33 19.85 Favored 'General case' 0 N--CA 1.477 0.911 0 CA-C-N 114.371 -1.286 . . . . 60.23 108.665 168.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -50.11 -37.12 32.47 Favored 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.704 0.802 . . . . 74.43 112.387 -178.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -55.27 -54.86 38.12 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.345 0.658 . . . . 54.42 111.892 174.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.6 mpt_? -68.71 -24.93 64.54 Favored 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 112.749 0.648 . . . . 74.42 112.749 -176.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 96.1 t -67.0 -53.96 29.09 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.167 0 C-N-CA 122.665 0.386 . . . . 65.2 109.96 171.353 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -56.36 -51.62 67.63 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 123.811 0.845 . . . . 74.42 111.91 178.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 79.9 t -56.41 -39.41 60.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 C-N-CA 124.124 0.97 . . . . 55.42 111.716 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.7 t90 -57.5 -54.28 48.67 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 110.237 -0.283 . . . . 75.12 110.237 175.522 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -61.88 -34.02 75.26 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 123.77 0.828 . . . . 75.31 113.088 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.3 mt-30 -63.67 -52.47 60.54 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 122.586 0.355 . . . . 70.15 111.404 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -72.89 -25.46 61.08 Favored 'General case' 0 N--CA 1.485 1.313 0 CA-C-N 116.125 -0.489 . . . . 63.44 111.449 177.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.1 tpt85 -70.75 -37.74 73.44 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.281 0.632 . . . . 74.05 111.145 178.252 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 34.2 mtp-105 -70.92 -37.6 72.92 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.209 0.604 . . . . 74.14 111.132 173.571 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.41 -29.38 70.44 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 122.879 0.472 . . . . 74.4 111.491 175.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -80.91 -49.32 11.16 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 123.902 0.881 . . . . 72.25 111.181 176.249 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -70.27 -54.98 10.38 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.571 1.149 . . . . 71.55 111.815 -173.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 72.8 ttt180 -73.4 86.81 1.52 Allowed 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.917 0.487 . . . . 63.33 109.743 179.539 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -144.26 114.8 7.63 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.164 0.586 . . . . 65.24 110.967 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 68.9 ttt180 -90.38 -20.79 22.43 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.348 1.059 . . . . 74.21 111.358 175.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 80.65 144.93 0.08 Allowed 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 126.068 1.747 . . . . 74.35 111.0 -163.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 33.2 mtp-105 -106.84 167.81 9.62 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.822 0.849 . . . . 55.42 111.674 -177.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -77.03 156.23 31.97 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.487 -0.779 . . . . 73.45 109.48 165.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -85.29 -114.91 0.77 Allowed Glycine 0 CA--C 1.536 1.388 0 N-CA-C 112.367 -0.293 . . . . 45.32 112.367 177.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -166.16 -52.64 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.997 0.919 . . . . 65.45 109.473 178.071 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 47.4 ttm -155.07 -47.08 0.08 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.057 0.543 . . . . 74.44 110.679 179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 56.2 60.6 3.11 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 124.178 0.991 . . . . 53.54 111.088 -177.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.4 pt20 . . . . . 0 CA--C 1.571 1.773 0 CA-C-N 114.34 -1.3 . . . . 72.05 111.737 -176.831 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 N--CA 1.496 1.83 0 CA-C-O 121.093 0.473 . . . . 41.11 110.661 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.3 t60 -79.99 130.97 35.69 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.139 0.576 . . . . 74.1 110.188 177.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.6 ptp -155.68 -165.34 1.94 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.241 0.616 . . . . 64.23 111.397 -172.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.0 m 73.67 4.56 4.75 Favored 'General case' 0 N--CA 1.5 2.036 0 C-N-CA 125.129 1.371 . . . . 71.25 113.711 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 17.7 m120 -79.81 101.92 8.78 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.95 0.5 . . . . 62.4 111.416 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -130.36 93.2 3.41 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.894 0.877 . . . . 73.24 110.089 173.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -77.88 -165.87 26.81 Favored Glycine 0 C--N 1.347 1.191 0 CA-C-N 115.653 -0.703 . . . . 43.22 113.066 176.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -82.37 117.62 22.57 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.875 0.47 . . . . 75.32 110.532 179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -85.58 31.45 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.652 0.781 . . . . 74.23 111.223 173.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -79.38 100.33 7.57 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.109 0.963 . . . . 60.23 110.312 -174.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -73.29 78.27 1.33 Allowed 'General case' 0 N--CA 1.484 1.253 0 CA-C-O 121.385 0.612 . . . . 74.45 109.951 174.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 55.3 t30 -79.12 93.16 5.13 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.762 -0.653 . . . . 64.3 110.58 -177.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 20.2 tpt180 -146.45 71.61 1.25 Allowed 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 108.435 -0.95 . . . . 72.41 108.435 175.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 11.3 t -155.85 9.55 0.27 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 114.833 -1.076 . . . . 53.41 111.089 -178.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 91.7 m -111.28 -67.22 1.01 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.151 0.98 . . . . 64.31 111.566 -171.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -88.16 132.48 34.32 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.419 0.688 . . . . 61.34 111.238 -175.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 21.0 p -75.97 169.09 18.84 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 122.347 0.259 . . . . 61.13 110.347 173.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.416 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 70.4 m -64.79 -40.17 94.79 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 122.309 0.244 . . . . 62.21 110.944 177.443 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 29.8 t80 -57.45 -45.97 84.15 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 123.687 0.795 . . . . 74.11 111.809 173.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.556 ' HG2' ' HB ' ' A' ' 46' ' ' THR . 76.0 mt-30 -59.22 -46.45 88.43 Favored 'General case' 0 N--CA 1.474 0.766 0 CA-C-N 115.597 -0.729 . . . . 74.15 111.43 178.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -61.17 -31.75 71.49 Favored 'General case' 0 N--CA 1.485 1.307 0 N-CA-C 112.586 0.587 . . . . 63.24 112.586 177.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 18' ' ' SER . 49.2 mt-10 -59.98 -50.72 72.62 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.89 0.476 . . . . 63.14 111.236 176.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -74.64 -35.19 62.86 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 112.82 0.674 . . . . 62.41 112.82 179.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.584 HD23 HD21 ' A' ' 42' ' ' LEU . 71.2 mt -62.01 -50.15 73.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.325 0.65 . . . . 71.33 110.868 177.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 71.3 mm-40 -60.71 -45.19 95.16 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.463 0.705 . . . . 63.43 111.437 172.536 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 29.3 tttm -56.3 -40.11 73.81 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.828 0.851 . . . . 75.42 112.494 -179.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 70.1 t -71.06 -39.38 74.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 123.048 0.539 . . . . 53.14 111.003 173.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.0 t80 -63.16 -38.78 92.51 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.546 0.738 . . . . 63.23 112.22 179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 78.8 mm-40 -76.3 -30.33 57.71 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.761 0.425 . . . . 74.11 111.532 -175.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -71.29 -49.58 41.37 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.41 0.624 . . . . 75.01 110.336 170.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.4 t -146.24 109.45 4.69 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.391 1.076 . . . . 73.22 110.074 -176.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -60.57 -28.17 68.27 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.29 0.636 . . . . 71.44 111.799 -179.421 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 16.3 m-85 -117.89 88.37 30.67 Favored Pre-proline 0 CA--C 1.557 1.217 0 C-N-CA 124.035 0.934 . . . . 74.32 109.012 179.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.689 ' HD2' HH21 ' A' ' 61' ' ' ARG . 58.7 Cg_endo -68.39 133.8 29.22 Favored 'Trans proline' 0 C--N 1.38 2.192 0 C-N-CA 122.561 2.174 . . . . 75.31 112.969 178.778 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -79.46 -175.09 4.56 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 123.599 0.759 . . . . 72.32 111.086 174.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.405 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 11.9 p -58.89 -42.5 86.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 123.441 0.697 . . . . 73.14 111.963 -179.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -74.19 -37.24 63.98 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.897 0.879 . . . . 74.11 110.887 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.17 -34.99 74.36 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.953 0.501 . . . . 73.15 111.157 171.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 79.1 mtt85 -75.67 -31.68 59.86 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.319 0.648 . . . . 71.51 112.018 175.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.5 mm-40 -58.23 -53.91 52.99 Favored 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.4 0.619 . . . . 71.04 110.259 177.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -64.64 -45.46 86.7 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 114.736 -1.12 . . . . 71.45 110.999 -177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.584 HD21 HD23 ' A' ' 24' ' ' LEU . 46.5 tp -66.93 -42.4 85.4 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.62 0.768 . . . . 61.15 112.869 -177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -69.62 -33.25 72.38 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 123.016 0.526 . . . . 63.21 111.89 -177.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 73.4 mtm -73.44 -38.98 65.33 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 122.635 0.374 . . . . 73.41 110.707 173.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.24 -55.49 34.27 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.57 1.148 . . . . 73.1 111.125 177.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.556 ' HB ' ' HG2' ' A' ' 20' ' ' GLN . 77.8 p -89.91 -6.06 56.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.245 1.018 . . . . 63.23 113.275 -173.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 65.67 19.44 11.42 Favored 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 124.542 1.137 . . . . 74.12 112.745 -177.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . 0.658 HD22 ' HG2' ' A' ' 52' ' ' ARG . 94.9 mt -92.44 152.86 19.48 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.713 0.635 . . . . 73.14 112.713 -176.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 59.3 m -66.4 151.51 47.0 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 124.267 1.027 . . . . 61.23 110.668 171.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.414 ' O ' ' HG2' ' A' ' 54' ' ' GLN . 43.0 mt-10 -53.68 -48.54 69.39 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.847 0.459 . . . . 72.54 111.115 175.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.44 -35.95 72.89 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 124.087 0.955 . . . . 72.31 112.324 177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.658 ' HG2' HD22 ' A' ' 48' ' ' LEU . 13.2 tpp180 -64.43 -45.31 88.05 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.532 0.733 . . . . 74.21 110.903 178.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 80.8 t -62.28 -40.87 89.36 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 124.244 1.018 . . . . 74.04 111.189 177.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.454 ' O ' ' HG2' ' A' ' 58' ' ' GLN . 14.7 mm-40 -55.33 -54.74 39.74 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.355 0.662 . . . . 74.54 111.301 177.407 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 70.9 t -50.47 -46.81 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 124.464 1.105 . . . . 72.21 112.393 -179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 74.7 t90 -58.82 -53.16 61.52 Favored 'General case' 0 CA--C 1.552 1.046 0 O-C-N 123.485 0.49 . . . . 72.03 111.33 -177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -66.02 -31.46 72.36 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 112.649 0.611 . . . . 73.04 112.649 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 54' ' ' GLN . 28.4 mm-40 -63.52 -46.14 87.42 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 118.116 0.416 . . . . 73.41 111.467 176.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -73.14 -31.05 64.04 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.011 0.524 . . . . 61.44 112.051 176.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.8 tpt85 -68.81 -45.09 72.15 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.304 0.642 . . . . 75.54 111.737 -177.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.689 HH21 ' HD2' ' A' ' 34' ' ' PRO . 82.2 mtt180 -69.45 -37.41 77.34 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 123.405 0.682 . . . . 74.32 111.118 176.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.67 -39.92 90.2 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-N 115.432 -0.804 . . . . 54.05 111.518 177.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -79.54 -32.61 42.21 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.812 0.445 . . . . 74.14 111.472 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 71.4 t90 -60.46 -38.69 85.0 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.205 0.602 . . . . 63.33 110.609 -179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 52.5 mtt180 -93.23 -18.37 22.58 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.49 0.716 . . . . 73.42 111.567 173.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 20.7 pttp 40.14 56.06 2.6 Favored 'General case' 0 N--CA 1.505 2.304 0 C-N-CA 126.488 1.915 . . . . 64.44 113.642 -178.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 76.4 ttt180 -100.72 132.31 46.18 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 114.365 -1.289 . . . . 65.33 111.615 -175.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -66.08 131.89 47.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.941 0.496 . . . . 72.01 110.133 169.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -155.48 89.25 1.18 Allowed 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.16 0.584 . . . . 73.53 110.17 -173.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.7 p90 -64.47 138.95 58.69 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.51 0.724 . . . . 74.52 111.855 179.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -91.71 148.45 19.26 Favored Glycine 0 CA--C 1.537 1.452 0 CA-C-N 116.359 -0.382 . . . . 40.21 113.849 -177.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.1 pt20 -106.76 31.53 5.21 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 124.367 1.067 . . . . 73.01 111.243 179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 50.3 ttm -63.99 95.89 0.13 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.451 0.7 . . . . 74.51 112.649 -171.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -94.63 129.68 41.4 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 124.509 1.124 . . . . 71.04 110.38 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.491 1.578 0 C-N-CA 123.465 0.706 . . . . 75.33 111.898 -178.72 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.1 m . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 110.274 -0.269 . . . . 62.22 110.274 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -113.8 -43.91 3.23 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.12 0.568 . . . . 72.14 111.901 -175.039 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 ptp -158.9 29.7 0.22 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.857 0.863 . . . . 61.34 112.659 -178.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 71.1 m -77.56 81.41 4.02 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.28 0.562 . . . . 61.32 110.304 174.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 72.5 m-20 -75.04 -29.86 60.9 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.991 0.916 . . . . 73.02 112.643 -171.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -82.18 -0.12 43.53 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.152 0.581 . . . . 40.21 112.498 178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 73.41 43.93 35.86 Favored Glycine 0 C--N 1.352 1.461 0 N-CA-C 114.719 0.647 . . . . 61.32 114.719 172.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mttp -106.79 122.21 45.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 122.939 0.496 . . . . 71.21 110.408 169.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.6 ptpt -62.67 -39.33 93.59 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.504 1.122 . . . . 72.54 112.224 -177.253 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 61.11 175.15 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.073 1.349 . . . . 75.22 113.032 -175.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.4 ttm105 -76.06 130.15 37.91 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 109.363 -0.606 . . . . 72.54 109.363 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -67.63 141.96 56.57 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 120.969 0.414 . . . . 74.34 111.47 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -89.04 131.13 35.35 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.857 0.863 . . . . 73.3 110.309 -170.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 36.1 m -68.37 118.22 11.16 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.224 0.61 . . . . 64.21 110.7 176.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 3.0 m -94.12 -67.95 0.83 Allowed 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 123.061 0.545 . . . . 70.43 111.061 -176.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -110.14 161.4 15.6 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 123.149 0.58 . . . . 70.25 112.438 -172.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 20.8 p -98.48 165.87 11.63 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 124.092 0.957 . . . . 52.53 110.639 175.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 46.0 m -62.53 -35.12 78.4 Favored 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 123.206 0.602 . . . . 75.23 111.717 178.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -58.26 -49.83 75.72 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.984 0.914 . . . . 64.34 111.406 172.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.2 mt-30 -64.05 -44.79 91.42 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.388 -0.824 . . . . 74.52 110.955 -177.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.54 -30.64 71.44 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.551 0.74 . . . . 73.22 112.243 177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.7 -43.24 98.01 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.961 0.904 . . . . 73.1 111.108 177.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -78.82 -46.62 18.31 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.764 0.826 . . . . 75.5 111.438 179.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.485 HD23 HD21 ' A' ' 42' ' ' LEU . 70.0 mt -54.56 -47.79 72.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 124.587 1.155 . . . . 64.04 112.194 -178.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.471 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 62.4 mm-40 -61.57 -46.66 88.93 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.658 0.783 . . . . 70.51 112.598 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 53.5 mttp -59.07 -44.25 91.83 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.074 0.55 . . . . 74.55 111.96 178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.515 HG21 HD13 ' A' ' 42' ' ' LEU . 98.8 t -65.31 -37.72 80.82 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.06 0 C-N-CA 123.119 0.568 . . . . 74.42 111.076 175.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' HE1' ' HG3' ' A' ' 61' ' ' ARG . 88.1 t80 -64.16 -48.04 77.54 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.013 0.925 . . . . 75.11 112.729 -179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.471 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 72.0 mm-40 -65.75 -25.63 67.36 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.746 0.418 . . . . 71.14 111.655 -175.526 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -89.58 -40.43 12.62 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.574 0.75 . . . . 64.44 111.57 176.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -146.41 125.95 13.28 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.666 0.787 . . . . 71.52 110.933 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 26.2 m80 -85.77 1.84 47.98 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.523 0.729 . . . . 73.24 111.42 -178.181 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 5.2 p90 -153.68 94.69 2.92 Favored Pre-proline 0 CA--C 1.561 1.384 0 C-N-CA 124.89 1.276 . . . . 75.54 109.726 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -70.36 135.65 29.54 Favored 'Trans proline' 0 C--N 1.374 1.875 0 C-N-CA 122.099 1.866 . . . . 73.34 113.35 -178.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -66.05 176.73 1.58 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 124.078 0.951 . . . . 73.31 111.678 175.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 12.7 p -57.32 -42.82 81.06 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 112.589 0.589 . . . . 74.53 112.589 -175.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -82.26 -29.83 31.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.0 0.52 . . . . 75.32 111.398 179.39 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.01 -29.84 70.28 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 123.088 0.555 . . . . 74.24 111.347 173.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -71.93 -35.73 69.73 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.68 0.792 . . . . 65.12 109.94 172.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.2 mm-40 -61.23 -46.42 90.47 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 122.684 0.393 . . . . 71.54 111.262 173.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -58.18 -57.37 13.17 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.256 0.622 . . . . 72.44 110.852 177.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.515 HD13 HG21 ' A' ' 27' ' ' VAL . 31.5 tp -63.9 -41.51 97.68 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 123.694 0.797 . . . . 73.44 112.485 -176.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.75 -28.41 68.39 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.172 0.589 . . . . 62.04 111.994 177.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.5 mmt -86.53 -14.18 43.75 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 122.696 0.399 . . . . 71.33 111.684 173.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.2 mmp_? -90.96 -23.01 20.56 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 123.844 0.857 . . . . 74.44 112.488 175.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 68.4 p -120.22 -20.28 7.4 Favored 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 113.08 0.77 . . . . 75.04 113.08 -177.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 62.44 60.02 1.45 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.704 1.202 . . . . 64.12 111.606 -174.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 77.8 mt -124.0 157.18 35.02 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.51 0.724 . . . . 75.15 111.434 -179.043 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 85.8 m -68.5 143.58 54.92 Favored 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 123.028 0.531 . . . . 74.14 109.807 167.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -56.8 -40.12 75.38 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.373 0.669 . . . . 75.53 112.089 -178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.434 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -63.08 -42.4 99.63 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.216 0.606 . . . . 62.25 111.58 176.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 79.7 ttt180 -66.52 -35.24 79.76 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.565 1.146 . . . . 71.33 111.911 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 72.3 t -59.93 -48.85 86.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 C-N-CA 123.886 0.874 . . . . 72.15 110.107 171.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 53.1 mt-30 -62.83 -35.15 78.99 Favored 'General case' 0 N--CA 1.482 1.127 0 CA-C-N 115.29 -0.868 . . . . 74.4 112.251 179.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 51' ' ' ALA . 98.7 t -56.42 -47.16 81.95 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.145 0 C-N-CA 123.074 0.55 . . . . 71.14 111.082 173.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . 0.409 ' HZ3' ' HB2' ' A' ' 28' ' ' PHE . 83.2 t90 -58.04 -50.84 72.06 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.7 -0.682 . . . . 74.24 110.43 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -61.61 -34.94 76.52 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.402 0.681 . . . . 70.52 112.617 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -66.17 -50.85 62.51 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 118.528 0.604 . . . . 63.13 111.429 178.175 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -64.53 -35.63 81.57 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 123.432 0.693 . . . . 63.5 111.566 177.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 49.5 tpt85 -73.26 -40.76 64.37 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.494 0.717 . . . . 73.1 111.75 -177.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.416 ' HG3' ' HE1' ' A' ' 28' ' ' PHE . 20.5 mtp180 -67.63 -34.42 76.94 Favored 'General case' 0 N--CA 1.494 1.756 0 C-N-CA 123.802 0.841 . . . . 72.23 110.899 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.08 -46.54 86.95 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.768 0.827 . . . . 60.25 111.776 178.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.03 -24.47 37.86 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.816 0.446 . . . . 62.41 111.387 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 90.0 t90 -61.15 -32.55 72.27 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 123.828 0.851 . . . . 75.42 110.97 177.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -68.66 122.0 17.61 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.34 -0.846 . . . . 71.23 111.128 175.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp 64.14 -164.4 0.25 Allowed 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.867 1.267 . . . . 61.44 112.508 -179.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 5.5 mmt180 72.64 -59.57 0.56 Allowed 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 124.617 1.167 . . . . 74.13 109.026 -160.473 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 51.64 -175.85 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.244 0 C-N-CA 126.922 2.089 . . . . 62.1 115.124 162.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 67.97 151.34 0.08 Allowed 'General case' 0 CA--C 1.567 1.607 0 C-N-CA 124.097 0.959 . . . . 71.42 112.325 176.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 75.54 -57.53 0.58 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.862 1.665 . . . . 73.42 112.44 177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -70.09 72.55 0.56 Allowed Glycine 0 CA--C 1.537 1.452 0 C-N-CA 122.839 0.256 . . . . 62.52 112.826 176.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -88.28 135.45 33.44 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.981 0.913 . . . . 74.01 111.282 -173.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 19.5 ptp -155.78 137.0 13.83 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 124.28 1.032 . . . . 73.02 109.819 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.8 91.12 5.29 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 108.96 -0.756 . . . . 62.15 108.96 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 72.0 mt-30 . . . . . 0 CA--C 1.561 1.391 0 C-N-CA 123.184 0.594 . . . . 75.24 110.118 177.269 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 52.0 m . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 120.357 0.122 . . . . 74.33 110.81 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -150.87 134.99 16.8 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.183 0.593 . . . . 74.2 110.167 -176.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -67.94 125.48 26.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.159 0.583 . . . . 75.02 111.089 176.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 50.2 m 67.78 106.74 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 124.882 1.273 . . . . 71.55 113.349 174.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -119.36 115.44 24.13 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.559 0.744 . . . . 74.33 109.75 166.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 26.8 ttpp -83.51 92.84 7.69 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-O 121.274 0.559 . . . . 74.43 110.039 176.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -149.74 -47.94 0.02 OUTLIER Glycine 0 CA--C 1.53 1.02 0 CA-C-N 115.439 -0.801 . . . . 72.4 111.941 -178.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 3.8 tmmm? 60.84 81.06 0.2 Allowed 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.848 1.259 . . . . 64.2 111.114 174.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -99.13 22.17 10.77 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.462 0.705 . . . . 70.31 111.366 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 15.7 mmm-85 -80.01 -25.95 40.04 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.631 0.773 . . . . 74.34 110.746 174.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.4 tpp180 59.04 -94.51 0.05 OUTLIER 'General case' 0 CA--C 1.565 1.529 0 C-N-CA 124.761 1.224 . . . . 71.14 112.715 176.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 174.62 166.31 0.25 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 124.78 1.232 . . . . 62.33 108.92 -176.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? 62.76 2.8 1.02 Allowed 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 113.863 1.06 . . . . 73.33 113.863 -179.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 62.9 p -75.93 110.2 10.19 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.958 0.503 . . . . 72.22 110.775 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 73.5 p -83.42 41.55 0.78 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.974 0.91 . . . . 73.01 110.892 175.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.438 ' HA ' ' OE1' ' A' ' 20' ' ' GLN . 58.9 m-85 -129.98 128.58 42.35 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.368 1.067 . . . . 74.44 109.699 -173.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.8 p -79.64 174.36 11.66 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 122.425 0.29 . . . . 70.44 110.701 175.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.9 m -62.42 -37.91 87.68 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.616 0.366 . . . . 62.42 111.821 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -66.21 -46.98 75.37 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.245 0.618 . . . . 73.21 111.525 174.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.438 ' OE1' ' HA ' ' A' ' 16' ' ' PHE . 96.4 mt-30 -61.14 -49.36 77.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 122.715 0.406 . . . . 54.23 111.604 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 53.9 mt -60.04 -37.76 80.78 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.112 0.565 . . . . 71.13 112.405 176.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.417 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 35.3 tt0 -62.76 -51.21 68.02 Favored 'General case' 0 C--N 1.353 0.721 0 C-N-CA 122.863 0.465 . . . . 74.11 110.706 177.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.556 ' HA ' ' HD3' ' A' ' 26' ' ' LYS . 68.5 mm-40 -58.95 -45.27 90.87 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.187 0.995 . . . . 74.44 112.281 179.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.631 HD23 HD21 ' A' ' 42' ' ' LEU . 83.1 mt -56.32 -47.32 78.97 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.741 0.816 . . . . 70.3 110.601 174.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 33.9 mm-40 -58.98 -46.13 88.89 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 123.942 0.897 . . . . 73.23 112.194 175.276 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.556 ' HD3' ' HA ' ' A' ' 23' ' ' GLU . 27.7 mtpp -55.62 -47.15 77.05 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.106 0.962 . . . . 74.22 111.823 -177.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.9 t -66.34 -36.64 77.85 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.997 0 CA-C-N 115.505 -0.77 . . . . 74.21 110.747 177.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -68.28 -37.7 80.94 Favored 'General case' 0 N--CA 1.487 1.386 0 N-CA-C 112.231 0.456 . . . . 73.31 112.231 178.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 23.2 mm-40 -65.69 -44.88 84.86 Favored 'General case' 0 N--CA 1.487 1.401 0 CA-C-O 120.953 0.406 . . . . 73.51 110.438 -177.382 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -77.89 -42.7 32.44 Favored 'General case' 0 CA--C 1.556 1.203 0 CA-C-N 115.518 -0.765 . . . . 64.0 111.759 -176.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.8 t -132.83 120.02 21.01 Favored 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 121.558 0.694 . . . . 55.43 110.783 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 52.9 m80 -78.31 3.95 14.17 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 123.033 0.533 . . . . 65.34 112.179 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.4 p90 -142.82 88.17 8.6 Favored Pre-proline 0 CA--C 1.565 1.532 0 C-N-CA 124.663 1.185 . . . . 64.32 109.652 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -75.87 128.88 11.12 Favored 'Trans proline' 0 CA--C 1.559 1.741 0 C-N-CA 122.26 1.973 . . . . 74.34 113.429 -178.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -78.7 -171.32 2.48 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.28 0.632 . . . . 71.54 111.478 176.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.454 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.6 p -56.84 -53.42 42.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.015 0 C-N-CA 122.923 0.489 . . . . 70.51 111.675 176.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -70.82 -30.93 67.5 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.861 0.864 . . . . 74.43 111.545 -172.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.9 93.58 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-N 116.356 -0.384 . . . . 74.33 111.429 172.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 22.5 mtm180 -82.71 -20.18 36.57 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 123.384 0.673 . . . . 73.11 112.282 177.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 32.0 mm-40 -65.45 -56.22 13.67 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 118.213 0.46 . . . . 55.13 110.719 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -61.15 -41.5 96.86 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-N 115.628 -0.714 . . . . 62.32 110.608 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD21 HD23 ' A' ' 24' ' ' LEU . 37.2 tp -64.61 -51.44 62.67 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 114.554 -1.203 . . . . 73.3 112.345 -178.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.47 -28.21 69.51 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.033 0.533 . . . . 74.44 112.184 -177.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 37.2 mmt -68.19 -47.43 67.96 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 122.607 0.363 . . . . 74.35 111.783 174.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 45.8 mtp180 -69.67 -40.67 76.28 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 122.427 0.291 . . . . 74.5 111.446 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.9 p -81.24 -24.37 37.4 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.55 0.74 . . . . 74.33 112.732 -178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 68.58 21.28 8.07 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 124.756 1.222 . . . . 72.24 112.084 -173.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 85.7 mt -88.96 156.34 18.95 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.575 0.75 . . . . 64.41 112.226 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 26.1 m -76.08 148.99 37.54 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.63 0.772 . . . . 72.23 109.972 172.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -53.71 -35.61 61.33 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.878 0.871 . . . . 75.24 111.644 -179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -63.73 -46.6 84.63 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.448 0.699 . . . . 72.45 112.152 176.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.2 mpt_? -64.47 -35.83 82.22 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.687 0.395 . . . . 74.51 111.592 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.8 t -67.62 -53.83 28.25 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.542 0.737 . . . . 54.1 110.643 175.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 27.5 tt0 -68.09 -46.8 69.98 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.067 0.947 . . . . 73.55 112.175 -170.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 69.9 t -61.2 -37.42 77.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 C-N-CA 122.908 0.483 . . . . 54.12 111.2 177.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.0 t90 -57.88 -49.79 75.5 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.044 0.538 . . . . 72.12 110.756 176.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.4 m-85 -65.2 -42.09 93.89 Favored 'General case' 0 N--CA 1.484 1.27 0 N-CA-C 112.473 0.546 . . . . 61.32 112.473 179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 12.0 mm-40 -68.8 -33.86 74.56 Favored 'General case' 0 N--CA 1.486 1.373 0 CA-C-O 120.913 0.387 . . . . 73.43 111.614 -178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -67.73 -40.84 84.17 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.04 0.936 . . . . 75.44 109.879 172.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -39.69 94.08 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 115.249 -0.887 . . . . 71.33 111.249 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 83.1 mtp180 -72.89 -39.79 66.1 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.272 1.029 . . . . 64.44 111.44 178.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.24 -37.59 80.85 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.181 0.592 . . . . 64.34 111.449 177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 67' ' ' ARG . 13.1 tmtt? -75.68 -41.62 53.29 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.553 0.741 . . . . 71.14 110.672 174.486 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 92.3 t90 -57.41 -43.15 83.54 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 124.51 1.124 . . . . 71.35 112.008 -175.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 68.7 mtp180 -71.41 -72.23 0.23 Allowed 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 122.893 0.477 . . . . 72.43 110.591 177.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -169.97 115.1 0.52 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.766 0.826 . . . . 71.52 109.747 177.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.651 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 62.2 ttt180 -102.38 -50.1 3.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.442 0.697 . . . . 61.43 111.292 -178.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -76.47 129.13 36.07 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.941 0.4 . . . . 71.24 111.213 178.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -128.99 137.82 51.58 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 124.044 0.938 . . . . 74.23 110.36 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -146.26 -175.37 4.74 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.671 0.789 . . . . 74.41 110.683 174.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 110.04 39.09 1.59 Allowed Glycine 0 N--CA 1.478 1.473 0 CA-C-O 121.185 0.325 . . . . 74.43 112.754 -177.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 56.1 tp60 -99.77 99.88 10.75 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.039 0.935 . . . . 64.31 109.305 178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 24.2 ptt? -147.62 -35.5 0.23 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.144 0.794 . . . . 74.22 113.144 -175.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 63.57 119.05 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 C-N-CA 124.514 1.126 . . . . 54.32 111.392 -174.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 . . . . . 0 CA--C 1.577 1.999 0 N-CA-C 113.948 1.092 . . . . 64.11 113.948 -170.463 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.2 m . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 110.539 -0.171 . . . . 41.45 110.539 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -163.06 103.46 0.99 Allowed 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.761 0.824 . . . . 75.34 110.456 175.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.3 mtt -87.98 161.32 17.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.178 0.591 . . . . 63.32 110.432 171.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.8 m -74.81 148.49 40.25 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.733 0.413 . . . . 43.2 110.517 175.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 66.0 t30 -77.52 11.55 1.98 Allowed 'General case' 0 CA--C 1.575 1.907 0 N-CA-C 112.786 0.662 . . . . 64.15 112.786 -173.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.5 mptt -91.64 8.05 38.64 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.952 0.901 . . . . 72.13 111.265 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -65.1 117.87 11.09 Favored Glycine 0 CA--C 1.541 1.696 0 N-CA-C 113.628 0.211 . . . . 52.12 113.628 179.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -85.06 -175.29 5.69 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.897 0.879 . . . . 71.44 111.308 176.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.8 tttp -83.78 64.07 7.84 Favored 'General case' 0 CA--C 1.555 1.149 0 N-CA-C 108.462 -0.94 . . . . 73.32 108.462 164.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -100.34 18.59 18.51 Favored 'General case' 0 CA--C 1.565 1.523 0 C-N-CA 123.748 0.819 . . . . 62.23 110.834 -175.615 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.6 ttm180 72.58 129.72 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.112 1.365 . . . . 61.42 112.893 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.3 p30 -77.13 162.23 27.61 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.353 0.661 . . . . 62.5 111.617 175.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.71 83.58 5.32 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 122.942 0.497 . . . . 74.12 110.258 179.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 3.3 m -94.88 35.95 1.22 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-O 122.247 1.023 . . . . 62.51 109.617 177.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 51.5 p -90.76 114.12 26.4 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.997 0.919 . . . . 65.15 111.212 -174.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 62.54 -169.75 0.18 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.435 1.094 . . . . 75.23 112.926 172.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -137.73 178.7 6.91 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 123.277 0.631 . . . . 63.53 110.845 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.4 t -40.17 -66.41 0.31 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 125.833 1.653 . . . . 63.43 114.948 -169.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 84.9 t80 -61.94 -42.03 98.64 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 123.386 0.674 . . . . 65.25 111.519 -176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -59.28 -52.04 67.37 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.244 0.617 . . . . 73.12 111.264 -179.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.483 ' O ' ' HB2' ' A' ' 25' ' ' GLU . 81.3 mt -59.21 -43.23 92.27 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.56 0.744 . . . . 75.33 111.845 -179.067 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.87 -48.51 78.69 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 122.979 0.511 . . . . 70.44 112.105 178.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -59.76 -51.12 71.13 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.054 0.542 . . . . 72.52 111.75 179.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.529 HD23 HD21 ' A' ' 42' ' ' LEU . 61.4 mt -57.86 -40.39 80.06 Favored 'General case' 0 CA--C 1.562 1.439 0 C-N-CA 123.806 0.842 . . . . 74.04 111.532 176.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' LEU . 2.0 tm-20 -60.75 -56.08 25.52 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 125.095 1.358 . . . . 74.01 111.581 -178.472 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' LYS . 13.6 mptt -62.85 -40.15 96.58 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.627 0.771 . . . . 71.54 111.743 -178.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.437 ' HA ' ' HD2' ' A' ' 30' ' ' LYS . 93.3 t -67.67 -30.76 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 122.639 0.376 . . . . 74.21 111.858 178.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.41 ' CZ ' ' HB3' ' A' ' 60' ' ' ARG . 77.3 t80 -68.15 -33.79 75.14 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 122.817 0.447 . . . . 72.11 110.951 174.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 65.6 mm-40 -75.34 -31.74 60.68 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.188 0.595 . . . . 75.22 111.291 176.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.437 ' HD2' ' HA ' ' A' ' 27' ' ' VAL . 64.7 mttm -67.6 -57.5 6.33 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.376 0.67 . . . . 72.23 110.037 173.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.6 t -143.28 133.44 24.42 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.081 0.952 . . . . 63.33 111.006 -177.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 75.5 m80 -82.7 -13.08 57.01 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.285 0.634 . . . . 73.1 110.977 174.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 82.5 m-85 -126.1 85.11 60.22 Favored Pre-proline 0 CA--C 1.558 1.269 0 C-N-CA 124.395 1.078 . . . . 71.43 110.011 174.002 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -69.81 126.52 13.37 Favored 'Trans proline' 0 C--N 1.375 1.942 0 C-N-CA 122.116 1.877 . . . . 74.53 111.875 176.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 -63.07 164.16 8.85 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 123.666 0.786 . . . . 64.24 112.057 176.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.12 -47.41 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 123.358 0.663 . . . . 75.41 112.259 178.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -64.88 -41.15 95.87 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.513 0.725 . . . . 72.01 110.985 -178.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -63.21 -37.61 87.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 123.62 0.768 . . . . 64.14 112.091 176.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -67.07 -38.45 85.77 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.351 0.66 . . . . 73.02 111.062 178.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -67.65 -51.33 51.17 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.523 0.729 . . . . 72.45 111.907 179.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 23.8 mm-40 -58.14 -45.71 86.9 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.754 0.822 . . . . 74.51 111.412 177.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.529 HD21 HD23 ' A' ' 24' ' ' LEU . 36.5 tp -62.97 -40.6 98.21 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.793 0.837 . . . . 61.13 111.663 177.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.79 -39.74 94.1 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.444 0.697 . . . . 70.1 111.697 178.305 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 34.4 mmt -72.4 -31.9 65.93 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 122.932 0.493 . . . . 74.31 111.901 179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 2.4 mmp_? -62.27 -52.13 64.95 Favored 'General case' 0 N--CA 1.483 1.177 0 CA-C-O 121.333 0.587 . . . . 64.44 110.832 171.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.9 p -90.66 -3.38 57.55 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.371 1.069 . . . . 62.21 113.326 -170.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 58.04 33.97 23.75 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 124.695 1.198 . . . . 55.13 111.912 -174.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 96.3 mt -104.77 177.07 4.95 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.974 0.909 . . . . 62.32 111.935 178.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.7 p -105.81 161.3 14.54 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 124.006 0.922 . . . . 73.35 109.816 169.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.9 tt0 -56.19 -34.2 66.02 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.039 0.536 . . . . 55.24 111.594 177.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.467 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -53.31 -59.44 4.56 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.941 0.896 . . . . 72.31 111.643 176.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 86.8 mtt180 -62.46 -38.27 89.16 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 123.604 0.761 . . . . 75.41 112.735 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 69.4 t -60.3 -49.17 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.43 0.692 . . . . 45.34 111.185 176.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -64.34 -40.73 96.45 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.182 0.593 . . . . 64.41 111.844 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 51' ' ' ALA . 89.0 t -56.2 -44.15 78.4 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 C-N-CA 122.719 0.407 . . . . 54.34 111.371 177.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -63.84 -50.67 67.96 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 123.218 0.607 . . . . 64.13 111.099 -178.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 15.6 m-85 -63.51 -40.56 97.37 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.608 0.763 . . . . 71.04 112.099 -179.911 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -68.06 -32.67 73.17 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 123.644 0.778 . . . . 55.03 111.734 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -72.24 -44.23 63.19 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 122.967 0.507 . . . . 62.32 110.174 178.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' HB3' ' CZ ' ' A' ' 28' ' ' PHE . 0.0 OUTLIER -66.37 -30.05 70.35 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.669 0.788 . . . . 74.35 111.744 172.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.29 -34.64 68.3 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 109.109 -0.7 . . . . 75.31 109.109 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -70.08 -30.43 67.66 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.821 0.848 . . . . 65.13 111.578 173.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.52 -51.14 68.6 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.605 0.762 . . . . 71.12 110.261 171.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 20.5 t90 -62.88 -35.82 81.26 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.96 0.904 . . . . 74.24 110.443 176.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 8.8 mmm180 -95.29 51.94 1.37 Allowed 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 124.417 1.087 . . . . 73.5 111.551 178.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.4 ' HB3' ' HE2' ' A' ' 66' ' ' LYS . 35.1 ttpt 71.51 117.61 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.625 0 C-N-CA 124.037 0.935 . . . . 74.15 113.225 167.727 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.33 -68.76 0.36 Allowed 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 123.775 0.83 . . . . 75.2 112.016 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -79.37 116.01 19.35 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.169 0.588 . . . . 74.35 109.818 -177.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -77.49 11.94 1.8 Allowed 'General case' 0 N--CA 1.487 1.377 0 N-CA-C 113.144 0.794 . . . . 65.23 113.144 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.1 t80 -71.71 141.9 49.82 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.399 0.68 . . . . 51.14 111.438 178.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 134.1 -96.22 0.28 Allowed Glycine 0 C--N 1.343 0.956 0 N-CA-C 110.813 -0.915 . . . . 53.14 110.813 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -63.18 -39.64 95.22 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.03 0.532 . . . . 73.31 110.266 172.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 25.5 ttt -91.86 124.98 36.39 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.469 0.707 . . . . 54.4 110.158 170.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.6 91.73 3.41 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.953 -0.758 . . . . 75.41 108.953 178.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 . . . . . 0 CA--C 1.571 1.78 0 C-N-CA 123.279 0.631 . . . . 55.51 111.758 -175.757 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.8 t . . . . . 0 N--CA 1.494 1.753 0 N-CA-C 111.549 0.203 . . . . 72.24 111.549 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -73.36 88.09 1.55 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.12 0.568 . . . . 75.11 110.889 -176.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 66.9 mtm -92.54 114.75 27.38 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.853 0.861 . . . . 74.33 110.076 175.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -66.43 -60.77 2.44 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.859 0.864 . . . . 61.34 112.281 -178.538 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -90.3 97.27 11.09 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.913 0.485 . . . . 71.43 109.696 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 60.0 pttt -133.4 -19.56 2.15 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 123.806 0.842 . . . . 75.23 111.619 -178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.7 79.7 1.87 Allowed Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.185 0.421 . . . . 34.13 112.837 -179.859 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 96.1 mttt -86.15 162.27 18.45 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.591 0.756 . . . . 73.05 111.4 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -151.82 89.95 1.51 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.181 0.592 . . . . 74.34 110.609 -175.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -141.95 106.14 4.78 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.001 0.92 . . . . 75.34 110.621 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.461 ' HB3' ' HG3' ' A' ' 13' ' ' ARG . 4.8 mpt_? -81.39 -45.89 15.44 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.941 0.496 . . . . 75.5 110.213 172.264 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.21 36.08 25.48 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.098 0.959 . . . . 60.21 112.419 176.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.461 ' HG3' ' HB3' ' A' ' 11' ' ' ARG . 69.6 mtp180 -66.49 -23.24 66.22 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.697 0.799 . . . . 64.12 111.544 -178.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 27.1 m 69.92 89.9 0.1 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.078 1.351 . . . . 72.11 111.734 175.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 80.8 p -82.47 -35.55 27.35 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.908 0.883 . . . . 73.52 111.092 175.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 m-85 -71.52 119.43 15.66 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.294 0.638 . . . . 63.21 109.941 175.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 17.2 p -69.92 167.7 16.86 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 122.812 0.445 . . . . 62.42 111.678 -178.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.427 ' O ' ' HG3' ' A' ' 22' ' ' GLU . 42.9 m -53.77 -44.93 70.45 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.266 0.626 . . . . 64.22 111.598 179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 80.3 t80 -63.24 -47.32 82.97 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.577 0.751 . . . . 74.32 111.999 178.214 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 95.1 mt-30 -59.98 -44.5 94.45 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.028 0.531 . . . . 72.03 110.856 -178.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.0 mt -58.09 -42.31 85.36 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.597 0.759 . . . . 73.33 112.27 175.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 46.4 mt-10 -55.92 -56.18 23.74 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.046 0.538 . . . . 51.52 111.566 176.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -61.6 -45.41 94.23 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.976 0.91 . . . . 54.25 112.241 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 80.1 mt -61.7 -45.1 95.42 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 123.921 0.888 . . . . 53.21 111.514 177.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 35.7 mm-40 -61.45 -41.9 97.93 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.782 0.833 . . . . 73.0 112.506 178.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 22' ' ' GLU . 64.1 mttm -53.35 -42.85 67.2 Favored 'General case' 0 N--CA 1.5 2.056 0 C-N-CA 123.378 0.671 . . . . 75.3 111.445 178.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 HD22 ' A' ' 42' ' ' LEU . 55.5 t -72.47 -39.67 62.63 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.106 0 CA-C-N 115.085 -0.961 . . . . 44.22 111.076 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 68.3 t80 -64.6 -38.4 90.89 Favored 'General case' 0 N--CA 1.497 1.892 0 C-N-CA 123.384 0.674 . . . . 63.13 112.13 -179.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 31.6 mm-40 -67.63 -36.08 80.13 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.069 0.547 . . . . 74.44 111.383 -179.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -78.01 -44.6 26.09 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.146 0.579 . . . . 53.42 111.155 178.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -150.71 129.12 12.09 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.197 0.999 . . . . 61.02 110.865 -176.862 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 m80 -78.12 -19.34 54.3 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.789 0.435 . . . . 72.01 111.022 178.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.2 m-85 -120.17 88.61 41.7 Favored Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 124.714 1.206 . . . . 75.42 109.82 178.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -70.31 150.09 64.32 Favored 'Trans proline' 0 C--N 1.373 1.833 0 C-N-CA 122.606 2.204 . . . . 75.14 113.475 179.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -66.58 163.0 19.69 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.449 0.7 . . . . 71.34 111.331 173.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.491 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.3 p -59.24 -48.9 85.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 N-CA-C 110.632 -0.136 . . . . 65.42 110.632 173.115 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 68.6 t80 -63.54 -31.77 73.03 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.487 1.115 . . . . 64.1 111.519 -178.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.14 -48.34 71.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.935 -0.575 . . . . 61.11 111.297 173.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 72.3 mtm180 -71.92 -23.2 61.43 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 123.09 0.556 . . . . 73.12 112.351 -179.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 38.3 mm-40 -64.91 -56.39 13.62 Favored 'General case' 0 N--CA 1.487 1.424 0 CA-C-O 121.242 0.544 . . . . 73.13 110.663 175.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -67.93 -34.49 76.69 Favored 'General case' 0 CA--C 1.55 0.981 0 CA-C-N 115.196 -0.911 . . . . 62.52 111.478 179.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 27' ' ' VAL . 56.0 tp -65.2 -41.85 94.1 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.438 0.695 . . . . 74.24 111.264 177.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.0 -36.49 81.67 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.172 0.589 . . . . 63.22 111.657 176.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.4 mtt -66.36 -49.19 67.75 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.387 0.675 . . . . 65.52 111.331 175.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 46.3 mtp180 -60.62 -45.64 93.26 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.843 0.857 . . . . 74.53 111.772 -178.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 p -79.17 -18.73 52.53 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.303 0.641 . . . . 73.24 112.423 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.0 t70 68.57 20.06 8.48 Favored 'General case' 0 CA--C 1.567 1.634 0 C-N-CA 124.582 1.153 . . . . 45.52 111.151 -175.085 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.6 mt -95.6 163.22 13.3 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.282 1.033 . . . . 64.25 111.232 176.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 60.5 p -81.95 162.82 22.56 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.192 0.597 . . . . 53.24 110.828 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -57.54 -43.05 84.09 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 122.733 0.413 . . . . 72.05 111.428 178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -64.65 -35.92 82.57 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 122.951 0.5 . . . . 72.21 112.151 177.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.61 -43.56 89.22 Favored 'General case' 0 N--CA 1.492 1.665 0 CA-C-O 121.126 0.489 . . . . 63.21 110.715 179.486 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.88 -47.85 91.34 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.329 0 C-N-CA 124.171 0.989 . . . . 75.05 110.902 173.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.56 -49.92 74.79 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.449 1.1 . . . . 64.42 112.005 -179.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 77.3 t -62.32 -39.2 83.31 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 C-N-CA 123.703 0.801 . . . . 41.23 111.442 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.6 t90 -60.25 -51.15 70.79 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.834 0.454 . . . . 73.13 111.212 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 59.0 m-85 -65.37 -29.39 70.1 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.156 0.582 . . . . 74.42 112.173 178.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.2 mm-40 -74.31 -35.89 63.69 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 118.191 0.451 . . . . 72.33 112.046 175.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 90.9 m-20 -65.17 -37.55 87.71 Favored 'General case' 0 N--CA 1.489 1.509 0 CA-C-O 121.43 0.633 . . . . 74.31 110.399 172.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -73.79 -35.83 64.97 Favored 'General case' 0 CA--C 1.554 1.106 0 C-N-CA 124.182 0.993 . . . . 65.15 111.089 179.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.664 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 21.6 mtm180 -82.52 -17.21 45.87 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 112.667 0.617 . . . . 73.43 112.667 177.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -60.26 -53.61 55.6 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.997 0.519 . . . . 72.03 111.154 176.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -73.45 -31.25 63.69 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 115.604 -0.726 . . . . 72.41 111.224 177.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.664 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 86.9 t90 -64.87 -29.97 70.95 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 123.827 0.851 . . . . 75.11 111.618 175.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 24.0 mmt180 -76.22 -11.73 59.97 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 112.951 0.722 . . . . 54.02 112.951 176.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt 76.18 -54.64 0.6 Allowed 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.33 1.052 . . . . 64.32 113.69 169.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -82.25 48.88 1.32 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.55 0.74 . . . . 72.45 112.269 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -79.31 80.43 5.67 Favored 'General case' 0 CA--C 1.56 1.333 0 O-C-N 121.817 -0.552 . . . . 75.01 109.695 -179.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 178.52 -55.51 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 126.353 1.861 . . . . 74.44 108.862 176.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 84.9 m-85 68.58 -64.05 0.32 Allowed 'General case' 0 N--CA 1.498 1.926 0 C-N-CA 125.449 1.499 . . . . 70.51 113.83 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -54.29 153.99 9.1 Favored Glycine 0 CA--C 1.541 1.714 0 N-CA-C 116.012 1.165 . . . . 71.4 116.012 -178.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -74.09 172.49 11.61 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.412 1.085 . . . . 51.2 112.658 -172.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 54.7 mtt -66.03 93.94 0.22 Allowed 'General case' 0 CA--C 1.558 1.276 0 C-N-CA 123.467 0.707 . . . . 74.13 110.845 179.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.97 111.08 10.98 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.646 0.378 . . . . 74.31 110.973 178.338 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 47.7 tt0 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 123.4 0.68 . . . . 62.33 111.95 -176.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.9 t . . . . . 0 N--CA 1.495 1.819 0 N-CA-C 110.391 -0.225 . . . . 55.15 110.391 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 60.7 m80 -58.33 135.83 57.26 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.412 0.685 . . . . 64.24 111.186 175.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.5 mtt 66.42 175.95 0.23 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.781 1.232 . . . . 51.44 111.791 -171.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.1 t 58.74 86.74 0.08 Allowed 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 124.41 1.084 . . . . 72.4 112.176 -176.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -85.29 170.54 12.7 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 112.783 0.66 . . . . 74.41 112.783 -174.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -66.9 102.86 1.02 Allowed 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.529 0.731 . . . . 64.24 111.066 176.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -154.27 154.37 25.47 Favored Glycine 0 N--CA 1.47 0.935 0 CA-C-N 116.081 -0.509 . . . . 75.22 112.617 179.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 55.1 mtpt 63.06 -178.91 0.15 Allowed 'General case' 0 N--CA 1.493 1.676 0 C-N-CA 124.127 0.971 . . . . 71.54 112.341 -178.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.401 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 3.4 mptp? -96.34 -83.14 0.38 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 122.734 0.414 . . . . 74.44 109.962 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 46.7 ttt85 64.15 164.31 0.13 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.573 1.149 . . . . 63.33 113.229 173.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 49.0 mtp85 61.87 31.31 18.28 Favored 'General case' 0 N--CA 1.499 2.017 0 C-N-CA 123.927 0.891 . . . . 54.45 113.289 170.021 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.5 p30 -118.17 165.22 14.06 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.541 0.736 . . . . 75.31 111.862 -176.578 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.7 tpt180 66.47 107.63 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 124.923 1.289 . . . . 72.41 112.414 178.074 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 81.7 p -75.22 107.11 7.1 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.157 0.583 . . . . 64.24 110.436 175.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 38.2 m -113.71 -75.4 0.6 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.17 0.588 . . . . 62.1 110.394 -179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -117.64 130.82 56.61 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.873 0.469 . . . . 54.24 110.26 177.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 24.7 p -79.77 168.75 18.9 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 122.963 0.505 . . . . 74.14 111.034 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.7 m -63.16 -39.43 94.65 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.071 0.549 . . . . 75.21 111.698 179.746 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -63.98 -43.38 95.9 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.181 0.593 . . . . 72.34 111.19 175.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -61.31 -46.22 91.18 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.374 0.27 . . . . 33.14 111.064 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 88.6 mt -63.11 -26.38 68.8 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 112.373 0.509 . . . . 75.53 112.373 177.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.419 ' HB3' ' HE3' ' A' ' 26' ' ' LYS . 45.5 mt-10 -64.41 -59.96 3.73 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 109.969 -0.382 . . . . 61.0 109.969 170.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 28.6 mm-40 -62.23 -42.38 99.26 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.452 0.701 . . . . 73.33 112.356 -172.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.506 HD23 HD21 ' A' ' 42' ' ' LEU . 74.5 mt -57.72 -48.14 80.41 Favored 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.081 0.952 . . . . 74.4 110.936 176.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.521 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 3.9 mm-40 -67.37 -37.27 82.91 Favored 'General case' 0 N--CA 1.486 1.35 0 CA-C-O 119.249 -0.405 . . . . 74.21 111.853 175.687 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.419 ' HE3' ' HB3' ' A' ' 22' ' ' GLU . 95.8 mttt -61.26 -45.04 96.17 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.208 0.603 . . . . 55.13 111.425 -178.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.2 t -68.26 -32.1 54.34 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.109 0 C-N-CA 122.932 0.493 . . . . 71.21 110.778 175.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -68.22 -28.13 66.97 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.146 0.579 . . . . 63.41 111.1 173.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.521 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 22.1 mm-40 -74.98 -44.11 50.13 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 122.815 0.446 . . . . 74.11 110.383 175.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -66.5 -35.59 80.64 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.896 0.878 . . . . 73.43 111.174 178.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.8 t -163.63 121.73 1.9 Allowed 'General case' 0 CA--C 1.555 1.147 0 C-N-CA 123.964 0.905 . . . . 53.14 111.297 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.2 m170 -66.45 -16.41 64.09 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.042 0.537 . . . . 72.15 111.865 176.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 81.7 m-85 -125.08 90.29 51.22 Favored Pre-proline 0 N--CA 1.483 1.185 0 C-N-CA 124.556 1.143 . . . . 74.43 110.484 174.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -57.43 126.14 21.01 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.971 2.447 . . . . 74.12 113.769 177.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.7 m-20 -71.07 170.47 12.81 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.774 0.83 . . . . 71.23 111.342 175.164 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 14.5 p -54.08 -37.77 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 C-N-CA 122.952 0.501 . . . . 71.25 112.05 179.36 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -80.71 -35.45 33.54 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.349 0.66 . . . . 44.01 111.142 179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.26 -32.06 73.51 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.182 0.593 . . . . 41.51 111.991 177.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 25.6 mtt180 -73.83 -33.3 64.09 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.259 0.624 . . . . 71.25 110.901 176.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -68.38 -42.92 78.39 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.951 0.5 . . . . 73.14 111.331 175.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -59.64 -49.92 75.87 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.482 0.713 . . . . 70.24 110.887 174.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.506 HD21 HD23 ' A' ' 24' ' ' LEU . 23.2 tp -66.9 -35.04 79.1 Favored 'General case' 0 CA--C 1.552 1.037 0 CA-C-N 115.874 -0.603 . . . . 54.23 111.878 -179.438 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.23 -41.09 92.39 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.39 0.676 . . . . 71.15 112.384 177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 3.8 ppp? -80.68 -29.64 36.55 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 112.46 0.541 . . . . 61.11 112.46 178.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.502 ' HE ' ' HA ' ' A' ' 45' ' ' ARG . 2.0 mmp_? -63.33 -50.33 70.43 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 122.593 0.357 . . . . 73.52 111.51 175.454 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.8 p -92.99 -19.08 21.95 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 113.366 0.876 . . . . 73.15 113.366 -175.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.0 t70 69.43 17.39 8.09 Favored 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 124.566 1.146 . . . . 71.11 111.102 -172.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.2 mt -89.27 145.42 25.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.351 0.66 . . . . 74.54 110.076 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 68.6 p -67.53 160.2 28.16 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 122.357 0.263 . . . . 63.54 110.992 174.196 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -56.11 -37.14 69.01 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-O 121.167 0.508 . . . . 74.04 110.949 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.412 ' O ' HG23 ' A' ' 55' ' ' VAL . . . -68.68 -33.35 73.82 Favored 'General case' 0 CA--C 1.556 1.199 0 C-N-CA 123.905 0.882 . . . . 45.23 112.5 177.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 tpt180 -76.03 -41.96 49.3 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-O 121.131 0.491 . . . . 72.25 110.78 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 67.0 t -57.89 -39.73 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 124.351 1.06 . . . . 75.12 110.546 170.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -57.24 -49.93 74.49 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.574 0.75 . . . . 73.42 111.464 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 51' ' ' ALA . 90.9 t -54.02 -49.16 62.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 C-N-CA 123.328 0.651 . . . . 75.53 111.902 -179.57 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 73.1 t90 -60.77 -49.34 77.9 Favored 'General case' 0 CA--C 1.553 1.06 0 CA-C-N 115.983 -0.553 . . . . 73.45 110.55 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -69.38 -23.64 63.76 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 113.335 0.865 . . . . 71.24 113.335 -178.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -71.16 -42.93 68.47 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-N 118.692 0.678 . . . . 65.22 110.322 174.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.3 m-80 -77.5 -22.46 51.19 Favored 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 116.056 -0.52 . . . . 71.1 111.746 175.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 31.8 tpt85 -81.73 -49.71 10.12 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 122.404 0.282 . . . . 73.11 111.509 -177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 38.3 mtp180 -58.77 -34.72 71.75 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.186 0.595 . . . . 73.44 111.045 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -63.82 -57.6 9.39 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 122.788 0.435 . . . . 72.53 110.461 171.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -53.59 -31.81 48.46 Favored 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 124.718 1.207 . . . . 64.41 113.07 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 85.2 t90 -80.73 -37.44 30.53 Favored 'General case' 0 CA--C 1.558 1.263 0 C-N-CA 124.822 1.249 . . . . 75.12 111.753 -179.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 21.2 ttt180 -84.04 -64.47 1.16 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 124.056 0.943 . . . . 51.51 111.23 -177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -148.27 124.94 11.12 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.511 1.124 . . . . 52.41 109.126 -179.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.6 mtm180 -55.99 100.54 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.366 0 O-C-N 123.263 0.352 . . . . 73.21 110.3 178.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -58.63 134.33 56.68 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.241 1.016 . . . . 64.35 111.46 -172.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.2 tpp180 -135.58 102.52 5.14 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.271 0.628 . . . . 64.0 111.228 -175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -96.5 161.3 13.97 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 122.802 0.441 . . . . 72.44 110.392 170.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 138.14 -78.66 0.31 Allowed Glycine 0 N--CA 1.47 0.959 0 CA-C-N 116.376 -0.375 . . . . 74.02 112.267 -177.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -73.76 145.16 45.29 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 122.556 0.342 . . . . 70.15 110.439 173.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 13.8 tpt 60.33 98.86 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.907 1.283 . . . . 70.04 112.073 -170.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -108.93 118.57 37.14 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.487 0.715 . . . . 73.34 109.825 175.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 10.7 pt20 . . . . . 0 CA--C 1.57 1.737 0 C-N-CA 123.528 0.731 . . . . 74.44 112.151 179.971 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.2 m . . . . . 0 N--CA 1.493 1.71 0 CA-C-O 120.412 0.148 . . . . 70.44 110.989 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 27.6 t60 -137.93 102.53 4.73 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.237 0.615 . . . . 64.35 109.346 177.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.6 ptm -145.42 175.57 10.23 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 122.965 0.506 . . . . 74.22 111.808 -175.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 55.2 m -72.23 103.19 3.28 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.078 0.551 . . . . 74.52 110.423 173.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -84.18 54.81 3.08 Favored 'General case' 0 CA--C 1.564 1.487 0 C-N-CA 124.02 0.928 . . . . 74.34 110.406 -179.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -139.73 -31.22 0.68 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 124.571 1.148 . . . . 73.21 110.483 -178.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -79.51 33.27 2.07 Favored Glycine 0 C--N 1.359 1.811 0 N-CA-C 115.254 0.862 . . . . 73.44 115.254 -177.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -110.1 -37.68 5.51 Favored 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 123.72 0.808 . . . . 63.22 110.413 174.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp 58.93 78.34 0.26 Allowed 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.252 1.021 . . . . 73.01 110.878 -172.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 50.4 mtm-85 -85.15 170.09 13.23 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.414 -0.812 . . . . 74.31 111.218 -176.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HB3' ' HD2' ' A' ' 13' ' ' ARG . 0.0 OUTLIER -61.51 -53.42 56.6 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 122.802 0.441 . . . . 73.54 111.165 176.675 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 56.18 17.89 2.98 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 114.307 1.225 . . . . 62.42 114.307 173.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.489 ' HD2' ' HB3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -84.83 -4.31 59.03 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.488 0.715 . . . . 73.23 112.062 -177.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 57.5 m 79.56 119.27 0.05 Allowed 'General case' 0 N--CA 1.498 1.971 0 C-N-CA 125.497 1.519 . . . . 75.51 112.406 -178.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 86.3 m -147.48 -56.43 0.24 Allowed 'General case' 0 N--CA 1.49 1.554 0 C-N-CA 124.901 1.28 . . . . 74.51 108.595 171.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -127.66 130.14 48.41 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.257 1.023 . . . . 70.41 108.955 169.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -78.12 168.47 19.82 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.746 0.418 . . . . 73.31 110.8 175.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 34.8 t -56.67 -50.14 72.97 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 122.611 0.364 . . . . 52.43 110.816 175.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.9 t80 -50.19 -51.01 47.46 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 124.196 0.998 . . . . 73.05 112.535 175.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.9 mt-30 -59.9 -51.6 69.0 Favored 'General case' 0 N--CA 1.485 1.278 0 O-C-N 123.596 0.56 . . . . 75.42 111.169 179.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.6 mt -56.21 -38.61 71.25 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.201 1.0 . . . . 72.34 112.917 179.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.05 -41.61 63.97 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.409 0.683 . . . . 71.11 111.867 -177.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 48.0 mm-40 -67.54 -37.41 82.66 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 122.974 0.51 . . . . 73.42 111.699 174.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.499 HD23 HD21 ' A' ' 42' ' ' LEU . 59.9 mt -62.74 -47.81 81.95 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.526 0.73 . . . . 74.15 110.657 175.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.461 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 29.3 tt0 -69.41 -31.96 70.65 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.941 0.897 . . . . 72.23 111.857 -179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 72.1 tttt -55.04 -45.09 75.19 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 124.847 1.259 . . . . 70.43 111.501 172.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 66.2 t -77.44 -26.85 15.48 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 123.307 0.643 . . . . 63.32 111.193 175.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -69.89 -32.33 70.62 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 123.754 0.822 . . . . 64.23 111.706 177.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 79.3 mm-40 -71.72 -29.12 64.2 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 122.971 0.508 . . . . 75.12 110.911 175.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -82.07 -35.41 28.7 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.504 0.722 . . . . 75.14 111.483 176.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.1 t -160.99 134.52 6.67 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.784 0.834 . . . . 74.14 111.142 178.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 71.6 m80 -82.58 -9.35 59.43 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.452 0.701 . . . . 75.32 112.115 -178.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -136.26 107.14 9.42 Favored Pre-proline 0 CA--C 1.557 1.241 0 C-N-CA 124.806 1.243 . . . . 74.44 108.442 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_endo -72.23 125.66 11.01 Favored 'Trans proline' 0 C--N 1.374 1.918 0 C-N-CA 122.123 1.882 . . . . 71.53 112.834 -168.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 5.9 m-20 -60.49 160.64 8.59 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 123.714 0.806 . . . . 74.21 110.459 172.479 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 9.3 p -53.56 -42.65 50.92 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 112.401 0.519 . . . . 73.55 112.401 -177.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -82.04 -28.86 32.23 Favored 'General case' 0 CA--C 1.554 1.099 0 C-N-CA 123.267 0.627 . . . . 63.41 111.816 179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.31 -37.54 78.02 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.092 0.557 . . . . 51.13 111.703 174.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.466 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 43.8 mtm180 -64.01 -39.74 94.79 Favored 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 123.408 0.683 . . . . 75.01 110.863 175.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.8 mm-40 -64.5 -57.24 9.75 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.495 0.718 . . . . 64.33 111.795 -173.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -58.68 -39.28 80.23 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.718 0.807 . . . . 75.35 111.902 177.177 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.499 HD21 HD23 ' A' ' 24' ' ' LEU . 24.4 tp -67.46 -40.42 85.34 Favored 'General case' 0 CA--C 1.553 1.06 0 C-N-CA 123.443 0.697 . . . . 71.1 111.659 178.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.1 -33.16 67.65 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.533 0.733 . . . . 71.35 111.445 -179.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 23.6 mmt -72.07 -25.14 61.65 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.4 0.68 . . . . 61.44 111.75 175.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 5.4 mmt180 -83.67 -47.7 10.95 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.427 0.691 . . . . 63.02 111.683 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.7 p -88.77 -13.51 39.3 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 113.125 0.787 . . . . 70.24 113.125 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.7 t70 68.1 14.65 9.34 Favored 'General case' 0 CA--C 1.575 1.927 0 C-N-CA 124.411 1.084 . . . . 54.04 111.626 -176.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.3 mt -87.43 156.86 19.39 Favored 'General case' 0 N--CA 1.485 1.283 0 O-C-N 121.54 -0.725 . . . . 64.14 111.757 -178.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.543 ' HB ' ' HD3' ' A' ' 52' ' ' ARG . 84.9 m -74.38 147.17 42.37 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.628 0.771 . . . . 52.14 111.241 176.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -42.74 -47.59 5.44 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 125.401 1.48 . . . . 73.03 112.797 174.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -58.51 -51.01 71.7 Favored 'General case' 0 N--CA 1.48 1.045 0 CA-C-N 115.715 -0.675 . . . . 42.12 111.746 176.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.543 ' HD3' ' HB ' ' A' ' 49' ' ' THR . 4.9 mpt_? -66.32 -23.77 66.42 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 123.168 0.587 . . . . 55.12 112.539 -176.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.435 HG13 HD23 ' A' ' 42' ' ' LEU . 74.5 t -64.92 -61.28 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 123.08 0.552 . . . . 63.44 110.018 171.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.43 -42.84 99.75 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.967 0.907 . . . . 64.53 112.244 -175.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 38.4 t -58.88 -41.06 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 C-N-CA 124.54 1.136 . . . . 74.22 111.771 175.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 87.8 t90 -59.69 -47.77 84.32 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 122.583 0.353 . . . . 72.23 111.016 178.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -59.93 -34.11 72.8 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.369 0.668 . . . . 72.51 111.945 177.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -64.45 -49.82 69.97 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.222 0.609 . . . . 73.11 111.503 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -73.52 -21.26 60.44 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 122.785 0.434 . . . . 61.32 111.924 178.125 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.521 HH21 ' HG3' ' A' ' 63' ' ' LYS . 1.5 tpm_? -79.77 -34.83 39.44 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.677 0.391 . . . . 74.44 110.995 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.575 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 22.4 mtm180 -67.6 -23.84 65.42 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 123.003 0.521 . . . . 54.32 111.527 172.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.436 ' HA ' HH21 ' A' ' 65' ' ' ARG . . . -64.54 -31.82 73.21 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.338 0.655 . . . . 45.15 111.528 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HG3' HH21 ' A' ' 60' ' ' ARG . 33.0 mmtm -83.3 -42.46 17.11 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.603 0.761 . . . . 65.04 111.835 171.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.575 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 68.7 t90 -56.89 -36.01 69.63 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 124.695 1.198 . . . . 75.23 112.383 -175.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.436 HH21 ' HA ' ' A' ' 62' ' ' ALA . 67.6 mtm180 -66.16 111.1 3.25 Favored 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 123.126 0.57 . . . . 74.43 111.062 172.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -70.98 131.78 44.19 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.665 0.786 . . . . 61.05 111.924 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 36.0 ptt85 -142.9 108.92 5.19 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.15 0.58 . . . . 74.01 110.717 174.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 64.04 5.68 2.52 Favored 'General case' 0 N--CA 1.495 1.816 0 C-N-CA 124.862 1.265 . . . . 74.41 113.946 173.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 19.1 mtm180 56.43 31.13 18.25 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.294 1.038 . . . . 70.33 111.3 -170.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 61.27 34.97 18.38 Favored 'General case' 0 CA--C 1.565 1.544 0 C-N-CA 124.979 1.312 . . . . 64.21 112.076 -175.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 93.51 -140.55 15.11 Favored Glycine 0 C--N 1.353 1.484 0 CA-C-N 115.836 -0.62 . . . . 62.13 113.4 175.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 61.08 55.0 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 124.719 1.208 . . . . 53.24 111.616 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 26.4 mmt -81.89 99.23 8.93 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-N 115.217 -0.901 . . . . 72.01 111.43 -178.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.4 mt-30 -118.64 -74.19 0.62 Allowed 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.683 0.793 . . . . 64.33 111.011 -179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 . . . . . 0 CA--C 1.571 1.751 0 C-N-CA 122.935 0.494 . . . . 75.1 111.282 176.156 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.0 m . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 110.595 -0.15 . . . . 73.31 110.595 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 p80 -83.24 49.26 1.52 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 113.267 0.84 . . . . 61.32 113.267 -173.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -114.47 -47.85 2.9 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.877 0.871 . . . . 75.55 110.231 172.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.8 m 58.92 32.53 22.34 Favored 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 124.392 1.077 . . . . 73.44 111.837 -175.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.58 73.88 0.35 Allowed 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.456 1.502 . . . . 43.32 111.974 -172.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 54.5 mtpt 55.52 -82.67 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 125.217 1.407 . . . . 75.42 114.028 173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 85.98 -139.9 17.34 Favored Glycine 0 C--N 1.35 1.345 0 N-CA-C 111.293 -0.723 . . . . 53.24 111.293 -171.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 mptt 59.2 25.0 13.47 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 124.593 1.157 . . . . 75.24 112.548 174.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -72.02 83.6 0.97 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.816 -0.809 . . . . 73.04 108.816 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 36.1 ptt180 -85.72 42.52 0.97 Allowed 'General case' 0 CA--C 1.555 1.158 0 C-N-CA 123.262 0.625 . . . . 63.31 112.456 -171.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 -73.52 89.6 1.7 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-O 121.907 0.86 . . . . 74.1 109.824 171.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -154.09 168.12 27.53 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.927 1.291 . . . . 73.14 109.258 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.417 ' HD2' ' HA ' ' A' ' 13' ' ' ARG . 22.7 tpt180 -83.1 153.51 24.82 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.302 -0.629 . . . . 64.12 109.302 173.124 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 37.9 m -63.28 95.92 0.1 Allowed 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.951 0.405 . . . . 73.53 110.44 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 75.0 p -94.85 -40.18 9.86 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.03 0.932 . . . . 73.23 110.935 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -140.18 157.72 45.16 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.118 0.967 . . . . 75.04 110.329 177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 30.6 p -91.71 168.08 11.73 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 123.156 0.583 . . . . 73.22 110.3 173.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 44.6 m -59.85 -40.82 89.84 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 123.386 0.675 . . . . 64.22 111.37 176.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -56.99 -52.66 64.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 124.228 1.011 . . . . 73.43 111.44 174.387 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -59.31 -45.57 90.95 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.779 -0.646 . . . . 73.4 111.165 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.7 mt -59.57 -45.15 92.68 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 123.642 0.777 . . . . 40.22 112.319 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -65.46 -33.33 75.69 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.227 0.611 . . . . 71.13 112.317 179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -72.95 -49.75 27.44 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 122.723 0.409 . . . . 53.41 111.76 176.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 49.8 mt -55.44 -41.21 72.53 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 124.047 0.939 . . . . 70.02 111.069 175.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 37.6 tt0 -74.83 -33.31 62.15 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 124.641 1.176 . . . . 54.1 112.462 -179.969 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.424 ' NZ ' ' HB2' ' A' ' 26' ' ' LYS . 4.6 ttmp? -63.08 -35.06 79.0 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.465 0.706 . . . . 70.24 110.805 177.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 97.1 t -79.16 -34.99 16.92 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 CA-C-N 115.322 -0.854 . . . . 73.43 110.889 173.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 78.2 t80 -61.49 -38.71 88.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 124.053 0.941 . . . . 71.11 112.244 178.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 25' ' ' GLU . 83.1 mm-40 -67.6 -25.85 65.97 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.229 0.612 . . . . 74.12 111.976 178.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mttp -83.99 -61.85 1.71 Allowed 'General case' 0 CA--C 1.554 1.1 0 C-N-CA 123.649 0.779 . . . . 73.24 110.193 175.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.9 t -133.77 134.2 42.63 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.217 1.007 . . . . 74.32 110.837 177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . 0.421 ' O ' ' HD3' ' A' ' 61' ' ' ARG . 10.3 m170 -83.8 -8.6 59.19 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.714 0.805 . . . . 71.32 110.85 178.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -135.23 73.88 63.23 Favored Pre-proline 0 CA--C 1.563 1.449 0 C-N-CA 123.92 0.888 . . . . 75.0 111.212 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -70.17 126.16 12.73 Favored 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 121.999 1.799 . . . . 74.42 111.828 178.034 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -71.81 177.82 4.0 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.116 0.566 . . . . 74.44 112.331 -179.24 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.424 ' O ' ' HG2' ' A' ' 40' ' ' GLU . 7.4 p -44.42 -48.11 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.937 0 C-N-CA 124.632 1.173 . . . . 53.01 114.094 -174.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -69.05 -37.93 78.82 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.761 0.824 . . . . 74.24 111.334 -177.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -70.6 -31.23 68.14 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 123.598 0.759 . . . . 71.32 111.654 176.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.697 HH11 HG12 ' A' ' 53' ' ' VAL . 36.2 mmt180 -66.34 -40.83 90.08 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.607 0.763 . . . . 75.3 110.299 174.315 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.424 ' HG2' ' O ' ' A' ' 36' ' ' VAL . 22.3 mm-40 -59.78 -57.05 14.6 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.706 0.802 . . . . 70.52 111.874 178.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -57.22 -43.95 83.29 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 124.178 0.991 . . . . 52.23 111.859 -177.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 28.1 tp -68.88 -41.85 77.79 Favored 'General case' 0 CA--C 1.553 1.069 0 CA-C-N 115.193 -0.912 . . . . 72.43 111.956 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -67.53 -35.53 79.26 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.179 0.592 . . . . 65.01 111.708 -179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.4 mmt -64.34 -46.37 83.77 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 122.967 0.507 . . . . 71.14 111.373 175.292 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 36.6 mtt-85 -57.51 -49.15 77.24 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.591 0.757 . . . . 63.43 111.971 176.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.37 -11.57 58.48 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.816 0.846 . . . . 64.24 112.882 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.1 t70 64.46 26.21 13.42 Favored 'General case' 0 CA--C 1.573 1.835 0 C-N-CA 124.628 1.171 . . . . 70.34 111.152 -174.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.9 mt -94.76 179.51 5.22 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.149 0.98 . . . . 74.21 111.656 177.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -118.01 167.67 11.24 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 124.256 1.023 . . . . 73.13 109.179 172.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 mp0 -46.28 -48.9 18.01 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.642 1.177 . . . . 63.3 112.583 -178.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -56.88 -45.18 82.71 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.574 0.75 . . . . 51.14 112.473 -179.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mpt_? -62.01 -47.63 83.92 Favored 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 123.263 0.625 . . . . 74.51 111.316 179.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.697 HG12 HH11 ' A' ' 39' ' ' ARG . 40.6 t -67.09 -37.93 80.23 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.347 0 CA-C-N 115.579 -0.737 . . . . 74.21 111.107 -179.474 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.5 mm-40 -61.81 -57.42 11.92 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.735 0.814 . . . . 70.25 111.113 177.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 76.0 t -54.24 -36.54 33.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 123.913 0.885 . . . . 73.52 112.09 -178.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 68.5 t90 -62.98 -55.33 26.75 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 122.486 0.315 . . . . 72.24 110.997 178.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -64.7 -34.96 79.54 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 122.998 0.519 . . . . 73.34 112.383 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.475 ' NE2' HH21 ' A' ' 61' ' ' ARG . 0.0 OUTLIER -62.78 -45.03 94.58 Favored 'General case' 0 N--CA 1.489 1.487 0 CA-C-O 121.468 0.651 . . . . 70.0 111.15 175.099 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.8 t-20 -65.03 -43.25 93.03 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 114.831 -1.077 . . . . 65.31 110.841 178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.42 -28.63 62.09 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.934 0.893 . . . . 75.35 112.695 -178.251 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 64' ' ' TRP . 45.6 mtm180 -82.26 -22.35 35.82 Favored 'General case' 0 N--CA 1.487 1.417 0 CA-C-N 118.169 0.44 . . . . 74.05 111.782 176.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.49 -45.29 76.29 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.377 0.608 . . . . 72.33 109.993 167.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 65.0 tttm -67.91 -31.56 71.42 Favored 'General case' 0 CA--C 1.562 1.441 0 C-N-CA 124.732 1.213 . . . . 55.15 111.747 175.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . 0.498 ' HB3' ' HA ' ' A' ' 61' ' ' ARG . 87.0 t90 -64.7 -21.29 66.71 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.991 1.316 . . . . 72.15 112.289 177.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.445 ' HG3' ' O ' ' A' ' 61' ' ' ARG . 80.0 mtt180 -80.8 -23.69 39.07 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.278 0.631 . . . . 73.11 112.604 177.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 9.2 mptt 51.53 98.67 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.869 0 C-N-CA 124.866 1.267 . . . . 74.04 113.041 -177.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 13.9 ttm180 -82.8 148.62 27.68 Favored 'General case' 0 CA--C 1.559 1.299 0 O-C-N 122.019 -0.425 . . . . 74.41 110.021 172.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 69.05 44.65 0.99 Allowed 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 124.894 1.278 . . . . 73.3 111.855 -174.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 58.2 mtt180 -62.19 -48.58 79.39 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 123.617 0.767 . . . . 72.15 110.89 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 32.6 p90 -82.24 164.56 21.1 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 115.252 -0.885 . . . . 75.25 111.049 176.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 84.79 169.55 45.99 Favored Glycine 0 CA--C 1.534 1.259 0 CA-C-N 116.272 -0.422 . . . . 74.04 113.917 179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.9 mp0 -83.6 160.37 21.42 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.51 0.724 . . . . 74.41 110.728 179.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 80.7 mtp -70.56 158.83 35.44 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 120.841 0.353 . . . . 73.1 111.012 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -71.75 134.6 46.32 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.102 0.561 . . . . 61.34 112.0 -175.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 . . . . . 0 C--O 1.258 1.512 0 C-N-CA 123.46 0.704 . . . . 72.43 110.163 178.661 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 42.0 t . . . . . 0 N--CA 1.495 1.788 0 CA-C-O 120.607 0.242 . . . . 61.53 111.239 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -132.15 135.18 46.2 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.806 0.842 . . . . 75.52 110.602 177.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 67.3 mtm -96.6 160.97 14.1 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.559 0.743 . . . . 52.45 110.612 175.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 78.6 p -76.35 77.03 3.11 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 112.571 0.582 . . . . 74.31 112.571 -174.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 64.6 t30 61.67 172.08 0.12 Allowed 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 124.639 1.175 . . . . 75.03 112.685 179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -106.64 95.07 5.48 Favored 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.858 0.837 . . . . 73.13 110.377 172.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -80.18 90.47 1.31 Allowed Glycine 0 CA--C 1.533 1.207 0 CA-C-N 115.56 -0.745 . . . . 53.14 113.377 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 26.3 pttm -97.4 16.21 20.79 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.142 0.577 . . . . 62.31 111.55 176.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -64.0 111.12 2.37 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.824 0.85 . . . . 72.43 112.197 -174.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -88.66 152.28 21.92 Favored 'General case' 0 CA--C 1.561 1.404 0 C-N-CA 123.592 0.757 . . . . 71.35 111.596 -178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.6 mpt_? 63.42 101.64 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 125.165 1.386 . . . . 61.33 113.349 174.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -98.93 13.05 34.0 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.693 0.797 . . . . 60.41 111.751 175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.9 tpp180 -67.13 99.35 0.66 Allowed 'General case' 0 CA--C 1.555 1.152 0 C-N-CA 123.223 0.609 . . . . 52.22 112.305 -174.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 10.5 t -138.08 26.91 2.67 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.947 0.899 . . . . 73.33 110.247 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 72.0 p -76.17 -53.17 8.67 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.461 0.704 . . . . 71.22 111.587 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 63.26 174.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 124.898 1.279 . . . . 70.33 112.903 -176.618 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 19.7 p -101.17 172.94 6.7 Favored 'General case' 0 N--CA 1.489 1.524 0 N-CA-C 109.816 -0.439 . . . . 64.23 109.816 170.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 53.5 m -64.33 -34.12 77.4 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 122.792 0.437 . . . . 74.52 111.323 176.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLU . 92.6 t80 -67.39 -46.89 71.92 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 122.844 0.458 . . . . 74.22 111.217 174.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 93.9 mt-30 -64.38 -38.41 90.94 Favored 'General case' 0 N--CA 1.483 1.178 0 O-C-N 122.125 -0.36 . . . . 74.11 111.497 -177.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 61.6 mt -69.18 -45.04 70.95 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 122.83 0.452 . . . . 70.32 112.193 176.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 19' ' ' TYR . 11.2 pt-20 -63.3 -34.03 76.8 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 118.062 0.392 . . . . 70.31 110.956 -179.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -71.67 -48.84 44.83 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 124.518 1.127 . . . . 73.04 112.839 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 96.3 mt -64.63 -38.76 92.11 Favored 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 122.896 0.478 . . . . 72.31 110.641 178.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 58.9 mm-40 -61.32 -47.17 87.17 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.446 0.699 . . . . 75.51 111.138 169.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -54.58 -39.73 68.08 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.083 0.953 . . . . 74.51 111.403 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 95.9 t -72.93 -47.02 50.38 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.095 0 C-N-CA 123.275 0.63 . . . . 64.53 111.273 176.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -61.87 -40.48 95.52 Favored 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 123.273 0.629 . . . . 73.31 112.269 -175.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 84.6 mm-40 -71.54 -24.73 61.99 Favored 'General case' 0 N--CA 1.484 1.238 0 C-N-CA 123.362 0.665 . . . . 63.13 112.589 -176.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -85.16 -46.93 10.64 Favored 'General case' 0 N--CA 1.488 1.457 0 CA-C-O 121.384 0.611 . . . . 74.24 110.353 173.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -146.35 133.09 19.98 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.346 1.058 . . . . 73.23 111.173 -177.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -81.34 -5.13 57.51 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.127 0.571 . . . . 65.41 112.267 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -124.37 102.59 33.15 Favored Pre-proline 0 CA--C 1.557 1.243 0 C-N-CA 124.084 0.954 . . . . 74.2 110.874 -179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -77.51 120.44 5.22 Favored 'Trans proline' 0 CA--C 1.564 1.993 0 C-N-CA 122.23 1.953 . . . . 74.2 112.62 170.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.435 ' O ' ' HG3' ' A' ' 39' ' ' ARG . 6.9 m-20 -67.49 153.63 43.26 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 123.672 0.789 . . . . 73.13 110.179 172.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 8.3 p -63.17 -33.61 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.535 0 CA-C-N 117.996 0.362 . . . . 75.12 111.788 -176.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -67.49 -39.55 85.19 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.635 0.774 . . . . 73.53 110.475 175.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.16 -28.63 67.45 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.627 -0.715 . . . . 40.21 111.329 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.435 ' HG3' ' O ' ' A' ' 35' ' ' ASP . 97.0 mtt180 -74.38 -30.02 61.8 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.643 0.777 . . . . 74.3 111.125 177.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 mm-40 -57.0 -57.04 14.31 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.132 0.491 . . . . 74.31 110.176 174.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 -63.17 -49.2 75.22 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 115.271 -0.877 . . . . 73.22 112.21 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 53.5 tp -58.52 -47.37 84.39 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 123.091 0.557 . . . . 75.34 111.943 -178.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.62 -37.34 87.23 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 112.461 0.541 . . . . 50.13 112.461 -178.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 92.4 mtp -75.71 -38.06 58.91 Favored 'General case' 0 N--CA 1.489 1.478 0 N-CA-C 111.99 0.367 . . . . 75.34 111.99 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -66.24 -45.46 80.51 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 122.73 0.412 . . . . 74.3 110.851 176.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 64.2 p -82.24 -9.09 59.62 Favored 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 112.766 0.654 . . . . 53.23 112.766 178.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 63.0 20.94 12.62 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.231 1.012 . . . . 70.21 112.283 -177.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 86.6 mt -94.0 157.2 16.21 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.474 0.71 . . . . 61.32 112.697 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 54.8 m -75.27 141.67 43.43 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.272 -0.876 . . . . 70.41 109.9 169.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -55.66 -40.02 71.71 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.508 0.723 . . . . 74.14 112.082 -178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -59.89 -49.19 78.65 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.164 0.586 . . . . 50.23 111.982 176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.2 ttp180 -67.24 -30.05 69.85 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 123.068 0.547 . . . . 73.32 112.17 -178.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 78.3 t -60.22 -51.11 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 C-N-CA 123.256 0.622 . . . . 73.43 110.378 171.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -60.27 -45.74 92.26 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.482 0.713 . . . . 73.12 111.966 -179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 75.2 t -54.51 -42.51 59.89 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.383 0 C-N-CA 123.664 0.786 . . . . 73.32 111.653 178.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 83.6 t90 -57.76 -51.94 67.52 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 122.723 0.409 . . . . 73.51 110.797 175.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -62.15 -28.94 70.01 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.665 . . . . 73.33 112.55 179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.1 mt-30 -71.0 -46.41 62.28 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.028 0.531 . . . . 71.32 111.235 177.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 59.8 m-80 -69.66 -30.76 68.52 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 122.342 0.257 . . . . 75.53 111.403 175.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 7.9 tpm_? -65.99 -40.93 91.6 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.76 0.824 . . . . 64.43 110.559 176.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 78.5 mtt-85 -71.05 -27.16 63.44 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.518 0.727 . . . . 72.15 111.808 173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.39 -27.65 62.5 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 122.797 0.439 . . . . 74.53 111.605 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.28 -27.01 32.62 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.821 0.449 . . . . 63.04 110.959 171.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TRP . . . . . . . . . . . . . 82.1 t90 -77.23 -39.68 47.6 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.493 0.717 . . . . 65.42 111.477 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.47 ' NH2' ' HB2' ' A' ' 68' ' ' GLU . 34.3 ttt180 -125.22 142.52 51.45 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 123.002 0.521 . . . . 73.24 111.482 -176.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -137.75 -37.8 0.59 Allowed 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 112.923 0.712 . . . . 55.31 112.923 -173.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 82.7 mmt-85 -58.93 -73.24 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 113.755 1.02 . . . . 74.11 113.755 -170.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.47 ' HB2' ' NH2' ' A' ' 65' ' ' ARG . 3.6 mp0 -99.98 161.0 13.88 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 118.465 0.575 . . . . 60.22 111.238 175.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -89.78 -34.49 16.15 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.844 0.457 . . . . 71.4 111.005 173.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 76.2 t80 55.15 92.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.948 1.299 . . . . 74.55 112.338 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -165.37 -175.69 36.22 Favored Glycine 0 N--CA 1.47 0.948 0 CA-C-N 116.43 -0.35 . . . . 73.24 113.398 -179.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -72.23 -47.59 49.28 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.266 0.626 . . . . 61.43 110.139 177.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 15.7 tpt -149.22 -78.26 0.14 Allowed 'General case' 0 CA--C 1.553 1.084 0 C-N-CA 122.791 0.436 . . . . 75.23 110.277 174.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -172.82 137.01 0.73 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.871 0.868 . . . . 74.51 109.969 -176.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 4.3 pp0? . . . . . 0 N--CA 1.489 1.484 0 C-N-CA 123.252 0.621 . . . . 71.3 111.643 177.521 . . . . . . . . 0 0 . 1 stop_ save_