data_1mtq_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 1mtq _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 8' ' ' ASN . . . . . 0.654 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.736 0.303 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.481 ' O ' HG22 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.654 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.882 0.372 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 . . . . . 0 N--CA 1.461 0.097 0 CA-C-O 120.792 0.33 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.513 ' O ' HG21 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.902 0.382 . . . . 0.0 111.643 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.611 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.611 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.538 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.604 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 10.8 t-20 . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.866 0.365 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.604 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.461 HG21 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.538 ' O ' HG21 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.538 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.588 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.488 ' O ' HG21 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . 0.728 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.728 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.572 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 m120 . . . . . 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.6 t-20 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.547 0.213 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.466 0.374 0 CA-C-O 120.538 0.209 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.486 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 120.839 0.352 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.462 ' O ' HG22 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.5 m120 . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.546 0.212 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.472 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.941 0.401 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.565 0.221 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 120.806 0.336 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.51 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.406 HD12 HG21 ' A' ' 1' ' ' ILE . 62.4 mt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -167.61 136.89 2.65 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.626 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -153.57 130.39 10.89 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.6 t -63.61 -23.44 67.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.026 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.8 t -64.35 -53.79 43.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.709 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.5 m -79.01 -23.83 44.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.088 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.654 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 -52.76 119.58 16.32 Favored Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.183 -179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.481 ' O ' HG22 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.654 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.481 HG22 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.533 ' HB3' ' CG2' ' A' ' 18' ' ' VAL . 70.6 m-80 -120.51 87.78 2.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 56.91 27.85 13.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.9 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.533 ' CG2' ' HB3' ' A' ' 15' ' ' ASN . 2.2 t -79.6 -35.65 16.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.4 t . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.115 178.537 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.424 HD11 HG23 ' A' ' 1' ' ' ILE . 19.3 mm . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.847 0.832 . . . . 0.0 109.936 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 58.4 mmt-85 -75.2 -45.68 38.9 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.17 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.85 147.42 53.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.998 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.39 -28.36 19.41 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.051 0.541 . . . . 0.0 111.737 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.479 ' HB2' ' O ' ' A' ' 2' ' ' ARG . 5.7 t -60.84 -43.43 98.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.343 0.592 . . . . 0.0 110.227 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.7 m -90.84 -36.68 14.07 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.148 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -52.99 118.08 12.83 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.513 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.42 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -120.42 99.31 6.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 59.52 32.41 21.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.599 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.2 t -78.72 -44.19 25.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.361 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.7 tp . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 122.565 1.174 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 34.82 0.45 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.772 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.95 109.21 0.69 Allowed 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.28 0.562 . . . . 0.0 110.423 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 37.1 t -62.71 -39.92 95.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.86 0.362 . . . . 0.0 111.031 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.1 t -60.42 -45.0 95.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.207 0.527 . . . . 0.0 110.076 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 m -73.29 -39.79 65.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.961 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -65.81 118.42 51.55 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.495 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.513 ' O ' HG21 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.513 HG21 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -122.89 101.05 7.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 60.34 36.78 20.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.59 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.6 t -86.69 -49.95 14.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.495 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.1 tt . . . . . 0 CA--C 1.533 0.298 0 CA-C-O 122.563 1.173 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -66.96 -41.03 87.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.235 -1.348 . . . . 0.0 111.788 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -67.67 134.69 51.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.626 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.436 ' C ' ' H ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 19.7 t -78.66 4.35 13.89 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.553 0.692 . . . . 0.0 109.771 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.436 ' H ' ' C ' ' A' ' 4' ' ' CGU . 4.4 t -87.47 -56.01 3.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.525 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CD2' ' A' ' 4' ' ' CGU . 7.2 m -82.04 -36.86 27.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.412 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 11.4 t-20 -54.9 114.25 6.68 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.643 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -118.27 100.89 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 59.71 36.0 22.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.66 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.3 -43.53 17.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.382 179.192 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.7 mm . . . . . 0 N--CA 1.455 -0.183 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -85.0 -41.97 15.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.751 0.31 . . . . 0.0 111.244 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.421 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 3.4 p30 -82.83 166.18 19.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.536 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.421 ' HB2' ' OD1' ' A' ' 3' ' ' ASP . 1.6 t -76.02 -14.71 60.22 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.2 t -65.93 -58.14 6.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.871 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -83.9 36.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.315 0.578 . . . . 0.0 110.783 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.611 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 -116.37 117.2 38.78 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.212 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.611 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.538 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -122.23 104.33 9.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 63.61 46.13 4.31 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.649 0.738 . . . . 0.0 111.178 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.2 t -106.73 -45.11 7.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.618 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.903 179.444 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.454 -0.254 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.626 ' HE ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -170.65 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.479 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.626 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 0.9 OUTLIER -150.84 143.66 24.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.508 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.706 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -92.03 -26.42 18.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.73 -57.86 8.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.707 0.289 . . . . 0.0 111.653 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.8 m -75.11 -22.13 58.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.253 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.706 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 10.8 t-20 -56.02 120.09 31.44 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.751 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.604 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.476 ' HB3' ' CG2' ' A' ' 18' ' ' VAL . 66.6 m-80 -118.94 91.22 3.5 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.0 t60 61.86 20.98 11.91 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.317 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.476 ' CG2' ' HB3' ' A' ' 15' ' ' ASN . 2.1 t -75.01 -36.89 39.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.864 179.059 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 68.1 mt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.415 HH12 ' CD1' ' A' ' 4' ' ' CGU . 49.7 ptt85 -82.97 128.96 34.95 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.36 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.97 116.77 29.2 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.415 ' CD1' HH12 ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.67 -28.9 68.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.921 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.89 -48.34 74.58 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.945 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -90.85 28.47 1.54 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -126.98 113.36 21.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HG21 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.461 HG21 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -120.26 108.49 14.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.4 t60 64.37 30.2 13.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.88 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 29.7 t -78.26 -46.65 25.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.19 178.858 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.2 pt . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.788 0.328 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.637 ' HG3' ' HG ' ' A' ' 4' ' ' CGU . 2.2 tpm_? -76.27 -66.21 0.83 Allowed 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 41.89 63.42 1.33 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 124.401 1.063 . . . . 0.0 113.27 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.637 ' HG ' ' HG3' ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 6.0 t -73.4 -12.81 60.94 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.45 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 6.8 t -80.18 -52.68 7.47 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.4 m -74.71 -44.15 51.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.813 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.44 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 -57.76 119.45 33.63 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.538 ' O ' HG21 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.538 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -120.13 97.26 5.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 57.67 34.78 24.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.728 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -84.22 -39.18 14.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.33 179.302 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.511 ' HA ' ' CD2' ' A' ' 4' ' ' CGU . 13.4 mm . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.829 0.823 . . . . 0.0 109.688 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -76.92 0.42 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.187 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.26 38.57 1.57 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.962 0.887 . . . . 0.0 109.977 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.535 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.527 ' H ' ' CD2' ' A' ' 4' ' ' CGU . 1.6 t -91.03 -33.5 15.49 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.344 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.6 t -54.69 -63.19 1.23 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.507 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.2 m -88.91 39.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.305 0.574 . . . . 0.0 110.854 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.588 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 -109.91 124.61 33.13 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.488 ' O ' HG21 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.588 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.488 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.525 ' HB3' ' CG2' ' A' ' 18' ' ' VAL . 6.3 m120 -121.62 89.86 3.2 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 55.87 30.65 16.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.92 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.525 ' CG2' ' HB3' ' A' ' 15' ' ' ASN . 2.6 t -83.29 -39.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.009 178.487 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.781 0.324 . . . . 0.0 110.523 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp85 -100.05 -31.2 11.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.208 0.528 . . . . 0.0 109.885 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -80.54 155.29 27.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.214 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.3 t -87.71 -27.73 22.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.037 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.434 ' HB3' OE21 ' A' ' 4' ' ' CGU . 9.7 t -60.94 -58.73 7.21 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.75 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -86.57 30.23 0.73 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.0 0.429 . . . . 0.0 110.833 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.728 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 -106.13 120.31 49.26 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.016 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.728 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.572 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.407 ' HB3' HG22 ' A' ' 18' ' ' VAL . 6.7 m120 -121.57 103.08 8.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 63.66 44.08 5.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.678 0.751 . . . . 0.0 111.235 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.407 HG22 ' HB3' ' A' ' 15' ' ' ASN . 53.9 t -102.9 -45.93 10.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.492 178.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.322 -0.593 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.975 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.831 0.348 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -71.5 127.59 33.07 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.461 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -71.06 115.29 10.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.554 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.502 ' H ' ' CD1' ' A' ' 4' ' ' CGU . 45.4 t -90.12 -32.77 16.52 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.5 t -66.56 -54.39 24.24 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.779 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.3 m -84.67 44.93 1.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.463 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.554 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.6 t-20 -143.86 118.04 6.0 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.468 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -119.28 99.29 6.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 61.47 33.9 18.33 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.566 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 22.1 t -85.81 -46.18 16.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.581 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.637 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.45 HD11 HG23 ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.956 0.407 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.504 ' HA ' HH11 ' A' ' 2' ' ' ARG . 3.2 tpp180 -91.5 66.83 5.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.26 0.553 . . . . 0.0 110.636 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.57 129.16 34.58 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.642 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.442 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.4 t -69.35 -24.99 63.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.136 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.442 ' HB3' OE22 ' A' ' 4' ' ' CGU . 5.0 t -64.18 -43.97 93.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.035 0.445 . . . . 0.0 109.907 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.1 m -85.3 -36.38 20.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.31 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.14 119.8 29.8 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -121.94 101.6 7.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.1 t60 63.44 28.47 15.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.996 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -74.94 -43.88 45.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.282 179.16 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 12.6 tt . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.817 0.341 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -71.16 -38.45 72.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.077 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -78.61 146.43 34.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.197 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.418 OE12 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 47.8 t -72.38 -23.34 61.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.777 -178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.418 ' HB3' OE12 ' A' ' 4' ' ' CGU . 5.6 t -69.75 -48.42 59.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -75.08 -38.98 61.09 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.352 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.69 112.56 6.3 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.432 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.486 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.486 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -120.24 98.7 6.19 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 61.28 30.94 19.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.892 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.2 t -82.7 -41.23 17.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.7 t . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.253 179.125 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.522 ' O ' ' HB3' ' A' ' 2' ' ' ARG . 66.1 mt . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' A' ' 1' ' ' ILE . 48.8 ttm-85 77.91 -36.14 0.21 Allowed 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.481 0.712 . . . . 0.0 110.751 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 1' ' ' ILE . 3.6 p30 -81.58 156.43 25.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.148 179.3 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.501 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -91.86 -37.84 12.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.245 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.448 ' HB3' OE12 ' A' ' 4' ' ' CGU . 7.5 t -65.91 -51.58 57.4 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.2 m -80.22 41.23 0.52 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.883 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.501 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.1 t-20 -143.42 116.66 5.98 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.462 ' O ' HG22 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -124.82 101.93 7.32 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 58.19 46.11 16.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.925 0.869 . . . . 0.0 111.267 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -103.65 -43.89 8.97 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.388 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.219 179.057 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 49.6 mm . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.794 0.33 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.428 ' NE ' ' HA ' ' A' ' 2' ' ' ARG . 3.4 tpm_? -161.81 -10.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -61.63 113.26 2.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.5 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.81 -25.05 67.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.598 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.1 t -69.08 -45.57 69.96 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -95.57 30.57 2.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.788 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 25.7 t-20 -126.87 112.94 22.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.553 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.553 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -121.57 106.52 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.36 35.79 9.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.169 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.9 -41.38 15.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.433 177.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.155 179.607 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 21.4 pt . . . . . 0 N--CA 1.461 0.075 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -122.27 -49.59 2.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.14 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.81 42.17 0.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.926 0.393 . . . . 0.0 110.959 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.6 t -54.47 -22.94 14.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.866 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.5 t -68.48 -45.47 72.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.175 0.512 . . . . 0.0 109.806 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -84.08 -35.47 23.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.064 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.2 t-20 -58.85 114.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.527 -178.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -120.37 98.48 6.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 63.3 27.38 15.41 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.987 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.0 t -75.19 -41.12 44.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.429 179.238 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.409 ' HA ' OE22 ' A' ' 4' ' ' CGU . 64.9 mt . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.326 -0.249 . . . . 0.0 110.326 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -88.05 -63.08 1.35 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -154.05 22.14 0.5 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 123.029 1.395 . . . . 0.0 109.252 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.409 OE22 ' HA ' ' A' ' 1' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.4 t -55.92 -24.58 38.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.296 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -61.9 -47.1 86.48 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.183 0.516 . . . . 0.0 110.239 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.7 t -92.97 -31.14 15.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.334 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -62.23 113.91 10.12 Favored Pre-proline 0 N--CA 1.464 0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.194 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.472 ' O ' HG21 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.472 HG21 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -119.0 102.42 8.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.7 t60 62.27 30.88 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.778 178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.2 t -76.82 -45.34 31.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 22.3 t . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.492 179.169 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 110.181 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 mtp85 -78.2 -31.53 49.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.428 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -81.36 136.06 35.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.648 -179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.505 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.0 t -71.17 -27.75 63.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.592 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.505 ' HB3' OE22 ' A' ' 4' ' ' CGU . 8.5 t -65.09 -52.73 53.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.6 t -67.55 -42.4 82.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.676 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.96 117.52 21.97 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.523 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -119.52 96.27 5.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 60.54 29.69 19.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.663 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.4 t -81.52 -39.24 16.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.415 179.196 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.4 HG23 HD11 ' A' ' 1' ' ' ILE . 11.9 tt . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.726 0.298 . . . . 0.0 110.464 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 28.9 ttt-85 -169.56 150.97 4.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.023 179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -73.1 160.88 31.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.951 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.488 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.43 -30.03 67.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.488 ' HB3' OE22 ' A' ' 4' ' ' CGU . 9.0 t -63.06 -53.5 52.77 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.276 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 59.5 m -70.52 -34.22 72.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.275 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -59.16 115.61 12.78 Favored Pre-proline 0 N--CA 1.464 0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.662 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -120.64 95.16 4.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.1 t60 65.57 15.01 9.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.671 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.2 t -68.35 -41.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.612 0.72 . . . . 0.0 109.48 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.569 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ILE . . . . . 0.467 HD11 ' N ' ' A' ' 1' ' ' ILE . 4.1 mp . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -169.31 130.8 1.14 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.463 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 8.4 t70 67.8 121.58 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.096 0.872 . . . . 0.0 110.473 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CGU . . . . . 0.623 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 41.9 t -74.97 -40.57 60.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.463 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 7.7 t -60.46 -49.22 78.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.239 0.542 . . . . 0.0 109.968 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -87.46 44.9 1.22 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.004 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . 0.623 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 13.6 t-20 -144.52 116.98 5.51 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.51 ' O ' ' HD3' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -124.91 108.39 11.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 62.24 37.79 13.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.398 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -88.03 -45.65 15.89 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.303 179.058 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.683 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.736 0.303 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.683 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.882 0.372 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.484 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 . . . . . 0 N--CA 1.461 0.097 0 CA-C-O 120.792 0.33 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 11.4 t-20 . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.902 0.382 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.459 ' O ' HG23 ' A' ' 13' ' ' VAL . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 9' ' ' PRO . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.477 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.552 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.637 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 10.8 t-20 . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.866 0.365 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.52 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.637 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 9' ' ' PRO . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.49 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.526 ' O ' HG23 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.494 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.749 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 m120 . . . . . 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.6 t-20 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.547 0.213 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.463 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 9' ' ' PRO . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.466 0.374 0 CA-C-O 120.538 0.209 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 120.839 0.352 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.567 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.2 t-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.9 t-20 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.546 0.212 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.941 0.401 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.565 0.221 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.425 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 120.806 0.336 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 . . . . . 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -167.61 136.89 2.65 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.626 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -153.57 130.39 10.89 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.6 t -63.61 -23.44 67.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.026 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.8 t -64.35 -53.79 43.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.709 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.5 m -79.01 -23.83 44.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.088 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.683 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 -52.76 119.58 16.32 Favored Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.183 -179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.683 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 71.7 m-20 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.667 ' HB3' HG21 ' A' ' 18' ' ' VAL . 70.6 m-80 -120.51 87.78 2.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 56.91 27.85 13.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.9 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.667 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.2 t -79.6 -35.65 16.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.4 t . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.115 178.537 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.847 0.832 . . . . 0.0 109.936 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 58.4 mmt-85 -75.2 -45.68 38.9 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.17 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.85 147.42 53.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.998 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.39 -28.36 19.41 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.051 0.541 . . . . 0.0 111.737 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' ARG . 5.7 t -60.84 -43.43 98.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.343 0.592 . . . . 0.0 110.227 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.7 m -90.84 -36.68 14.07 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.148 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -52.99 118.08 12.83 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.513 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.484 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -120.42 99.31 6.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 59.52 32.41 21.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.599 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.2 t -78.72 -44.19 25.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.361 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.7 tp . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 122.565 1.174 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -82.74 34.82 0.45 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.772 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.95 109.21 0.69 Allowed 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.28 0.562 . . . . 0.0 110.423 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 37.1 t -62.71 -39.92 95.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.86 0.362 . . . . 0.0 111.031 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.1 t -60.42 -45.0 95.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.207 0.527 . . . . 0.0 110.076 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 m -73.29 -39.79 65.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.961 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -65.81 118.42 51.55 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.495 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 59.6 m-20 -122.89 101.05 7.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 60.34 36.78 20.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.59 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.6 t -86.69 -49.95 14.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.495 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.1 tt . . . . . 0 CA--C 1.533 0.298 0 CA-C-O 122.563 1.173 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -66.96 -41.03 87.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.235 -1.348 . . . . 0.0 111.788 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -67.67 134.69 51.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.626 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 19.7 t -78.66 4.35 13.89 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.553 0.692 . . . . 0.0 109.771 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.4 t -87.47 -56.01 3.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.525 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CD2' ' A' ' 4' ' ' CGU . 7.2 m -82.04 -36.86 27.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 11.4 t-20 -54.9 114.25 6.68 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.643 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.459 ' O ' HG23 ' A' ' 13' ' ' VAL . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 9' ' ' PRO . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -118.27 100.89 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 59.71 36.0 22.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.66 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.3 -43.53 17.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.382 179.192 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.7 mm . . . . . 0 N--CA 1.455 -0.183 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -85.0 -41.97 15.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.751 0.31 . . . . 0.0 111.244 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 3.4 p30 -82.83 166.18 19.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.536 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 3' ' ' ASP . 1.6 t -76.02 -14.71 60.22 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.2 t -65.93 -58.14 6.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.871 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -83.9 36.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.315 0.578 . . . . 0.0 110.783 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 -116.37 117.2 38.78 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.212 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.477 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.552 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -122.23 104.33 9.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 63.61 46.13 4.31 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.649 0.738 . . . . 0.0 111.178 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.2 t -106.73 -45.11 7.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.618 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.903 179.444 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.454 -0.254 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.661 ' HE ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -170.65 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.479 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.661 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 0.9 OUTLIER -150.84 143.66 24.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.508 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.719 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -92.03 -26.42 18.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.73 -57.86 8.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.707 0.289 . . . . 0.0 111.653 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.8 m -75.11 -22.13 58.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.253 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.719 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 10.8 t-20 -56.02 120.09 31.44 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.751 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.52 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.637 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 9' ' ' PRO . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.712 ' HB3' HG21 ' A' ' 18' ' ' VAL . 66.6 m-80 -118.94 91.22 3.5 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.0 t60 61.86 20.98 11.91 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.317 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.1 t -75.01 -36.89 39.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.864 179.059 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 68.1 mt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.407 HH12 ' CD1' ' A' ' 4' ' ' CGU . 49.7 ptt85 -82.97 128.96 34.95 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.36 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.97 116.77 29.2 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.407 ' CD1' HH12 ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.67 -28.9 68.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.921 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.89 -48.34 74.58 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.945 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -90.85 28.47 1.54 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -126.98 113.36 21.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.49 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -120.26 108.49 14.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.4 t60 64.37 30.2 13.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.88 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 29.7 t -78.26 -46.65 25.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.19 178.858 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.2 pt . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.788 0.328 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.724 ' HG3' ' HG ' ' A' ' 4' ' ' CGU . 2.2 tpm_? -76.27 -66.21 0.83 Allowed 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 41.89 63.42 1.33 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 124.401 1.063 . . . . 0.0 113.27 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.724 ' HG ' ' HG3' ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 6.0 t -73.4 -12.81 60.94 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.45 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.4 ' HB3' OE21 ' A' ' 4' ' ' CGU . 6.8 t -80.18 -52.68 7.47 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.4 m -74.71 -44.15 51.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.813 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 -57.76 119.45 33.63 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.526 ' O ' HG23 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -120.13 97.26 5.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 57.67 34.78 24.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.728 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -84.22 -39.18 14.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.33 179.302 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.51 ' HA ' ' CD2' ' A' ' 4' ' ' CGU . 13.4 mm . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.829 0.823 . . . . 0.0 109.688 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -76.92 0.42 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.187 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.26 38.57 1.57 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.962 0.887 . . . . 0.0 109.977 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.546 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.534 ' H ' ' CD2' ' A' ' 4' ' ' CGU . 1.6 t -91.03 -33.5 15.49 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.344 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.6 t -54.69 -63.19 1.23 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.507 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.2 m -88.91 39.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.305 0.574 . . . . 0.0 110.854 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 -109.91 124.61 33.13 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.494 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.664 ' HB3' HG21 ' A' ' 18' ' ' VAL . 2.6 m-80 -121.62 89.86 3.2 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 55.87 30.65 16.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.92 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.664 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.6 t -83.29 -39.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.009 178.487 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.408 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.781 0.324 . . . . 0.0 110.523 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp85 -100.05 -31.2 11.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.208 0.528 . . . . 0.0 109.885 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -80.54 155.29 27.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.214 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.527 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.3 t -87.71 -27.73 22.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.037 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.448 ' HB3' OE21 ' A' ' 4' ' ' CGU . 9.7 t -60.94 -58.73 7.21 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.75 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -86.57 30.23 0.73 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.0 0.429 . . . . 0.0 110.833 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 -106.13 120.31 49.26 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.016 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.749 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -121.57 103.08 8.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 63.66 44.08 5.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.678 0.751 . . . . 0.0 111.235 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.9 t -102.9 -45.93 10.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.492 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.322 -0.593 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.975 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.831 0.348 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -71.5 127.59 33.07 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.461 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -71.06 115.29 10.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.572 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.459 ' H ' ' CD1' ' A' ' 4' ' ' CGU . 45.4 t -90.12 -32.77 16.52 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.5 t -66.56 -54.39 24.24 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.779 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.3 m -84.67 44.93 1.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.463 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.6 t-20 -143.86 118.04 6.0 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.468 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -119.28 99.29 6.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 61.47 33.9 18.33 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.566 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 22.1 t -85.81 -46.18 16.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.581 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.637 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.403 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.956 0.407 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.533 HH11 ' HA ' ' A' ' 2' ' ' ARG . 3.2 tpp180 -91.5 66.83 5.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.26 0.553 . . . . 0.0 110.636 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.57 129.16 34.58 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.642 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.46 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.4 t -69.35 -24.99 63.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.136 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.46 ' HB3' OE22 ' A' ' 4' ' ' CGU . 5.0 t -64.18 -43.97 93.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.035 0.445 . . . . 0.0 109.907 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.1 m -85.3 -36.38 20.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.31 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.14 119.8 29.8 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.463 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 9' ' ' PRO . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -121.94 101.6 7.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.1 t60 63.44 28.47 15.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.996 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -74.94 -43.88 45.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.282 179.16 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.425 HG21 ' HB2' ' A' ' 5' ' ' CYS . 12.6 tt . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.817 0.341 . . . . 0.0 110.325 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -71.16 -38.45 72.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.077 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -78.61 146.43 34.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.197 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.438 OE12 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.425 ' HB2' HG21 ' A' ' 1' ' ' ILE . 47.8 t -72.38 -23.34 61.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.777 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.438 ' HB3' OE12 ' A' ' 4' ' ' CGU . 5.6 t -69.75 -48.42 59.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -75.08 -38.98 61.09 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.352 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.69 112.56 6.3 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.432 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -120.24 98.7 6.19 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 61.28 30.94 19.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.892 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.2 t -82.7 -41.23 17.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.7 t . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.253 179.125 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.531 ' O ' ' HB3' ' A' ' 2' ' ' ARG . 66.1 mt . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' A' ' 1' ' ' ILE . 48.8 ttm-85 77.91 -36.14 0.21 Allowed 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.481 0.712 . . . . 0.0 110.751 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -81.58 156.43 25.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.148 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -91.86 -37.84 12.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.245 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' HB3' OE12 ' A' ' 4' ' ' CGU . 7.5 t -65.91 -51.58 57.4 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.2 m -80.22 41.23 0.52 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.883 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.1 t-20 -143.42 116.66 5.98 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.7 m-20 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.82 101.93 7.32 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 58.19 46.11 16.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.925 0.869 . . . . 0.0 111.267 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 51.5 t -103.65 -43.89 8.97 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.388 178.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.219 179.057 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 49.6 mm . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.794 0.33 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 3.4 tpm_? -161.81 -10.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -61.63 113.26 2.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.81 -25.05 67.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.598 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.1 t -69.08 -45.57 69.96 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -95.57 30.57 2.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.788 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 25.7 t-20 -126.87 112.94 22.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.567 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 -121.57 106.52 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.36 35.79 9.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.169 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.9 -41.38 15.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.433 177.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.155 179.607 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 21.4 pt . . . . . 0 N--CA 1.461 0.075 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -122.27 -49.59 2.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.14 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.81 42.17 0.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.926 0.393 . . . . 0.0 110.959 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.6 t -54.47 -22.94 14.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.866 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.5 t -68.48 -45.47 72.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.175 0.512 . . . . 0.0 109.806 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -84.08 -35.47 23.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.064 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.2 t-20 -58.85 114.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.527 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -120.37 98.48 6.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 63.3 27.38 15.41 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.987 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.0 t -75.19 -41.12 44.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.429 179.238 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 4' ' ' CGU . 64.9 mt . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.326 -0.249 . . . . 0.0 110.326 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -88.05 -63.08 1.35 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -154.05 22.14 0.5 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 123.029 1.395 . . . . 0.0 109.252 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.554 ' HB3' HG23 ' A' ' 1' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.4 t -55.92 -24.58 38.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.296 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -61.9 -47.1 86.48 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.183 0.516 . . . . 0.0 110.239 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.7 t -92.97 -31.14 15.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.334 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.9 t-20 -62.23 113.91 10.12 Favored Pre-proline 0 N--CA 1.464 0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.194 -178.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -119.0 102.42 8.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.7 t60 62.27 30.88 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.778 178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.2 t -76.82 -45.34 31.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 22.3 t . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.492 179.169 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ILE . . . . . 0.429 HG12 ' H ' ' A' ' 3' ' ' ASP . 14.2 tt . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 110.181 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 mtp85 -78.2 -31.53 49.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.428 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.429 ' H ' HG12 ' A' ' 1' ' ' ILE . 29.5 t70 -81.36 136.06 35.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.648 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.522 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.0 t -71.17 -27.75 63.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.592 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.522 ' HB3' OE22 ' A' ' 4' ' ' CGU . 8.5 t -65.09 -52.73 53.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.6 t -67.55 -42.4 82.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.676 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.96 117.52 21.97 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.523 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -119.52 96.27 5.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 60.54 29.69 19.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.663 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.4 t -81.52 -39.24 16.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.415 179.196 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.9 tt . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.726 0.298 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.403 ' HG2' ' N ' ' A' ' 3' ' ' ASP . 28.9 ttt-85 -169.56 150.97 4.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.023 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' N ' ' HG2' ' A' ' 2' ' ' ARG . 9.7 p-10 -73.1 160.88 31.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.951 178.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.501 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.43 -30.03 67.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.501 ' HB3' OE22 ' A' ' 4' ' ' CGU . 9.0 t -63.06 -53.5 52.77 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.276 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 59.5 m -70.52 -34.22 72.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.275 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -59.16 115.61 12.78 Favored Pre-proline 0 N--CA 1.464 0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.662 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.425 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -120.64 95.16 4.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.1 t60 65.57 15.01 9.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.671 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.2 t -68.35 -41.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.612 0.72 . . . . 0.0 109.48 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.569 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.1 mp . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -169.31 130.8 1.14 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.465 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 8.4 t70 67.8 121.58 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.096 0.872 . . . . 0.0 110.473 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CGU . . . . . 0.644 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 41.9 t -74.97 -40.57 60.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.465 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 7.7 t -60.46 -49.22 78.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.239 0.542 . . . . 0.0 109.968 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -87.46 44.9 1.22 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.004 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 13.6 t-20 -144.52 116.98 5.51 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -124.91 108.39 11.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 62.24 37.79 13.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.398 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -88.03 -45.65 15.89 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.303 179.058 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.683 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 . . . . . 0 N--CA 1.463 0.201 0 CA-C-O 120.736 0.303 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.683 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 . . . . . 0 N--CA 1.464 0.238 0 CA-C-O 120.882 0.372 . . . . 0.0 111.513 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.484 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 . . . . . 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 . . . . . 0 N--CA 1.461 0.097 0 CA-C-O 120.792 0.33 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m120 . . . . . 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 11.4 t-20 . . . . . 0 C--O 1.233 0.213 0 CA-C-O 120.902 0.382 . . . . 0.0 111.643 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.459 ' O ' HG23 ' A' ' 13' ' ' VAL . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 9' ' ' PRO . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 . . . . . 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 110.212 -0.292 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.477 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.552 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.637 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 10.8 t-20 . . . . . 0 N--CA 1.462 0.168 0 CA-C-O 120.866 0.365 . . . . 0.0 111.751 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.52 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.637 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 9' ' ' PRO . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 . . . . . 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.49 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 . . . . . 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 . . . . . 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.526 ' O ' HG23 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 . . . . . 0 N--CA 1.454 -0.27 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.494 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 . . . . . 0 N--CA 1.454 -0.256 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.468 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.749 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 m120 . . . . . 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.404 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.6 t-20 . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.547 0.213 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 . . . . . 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 . . . . . 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.463 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 9' ' ' PRO . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 . . . . . 0 N--CA 1.466 0.374 0 CA-C-O 120.538 0.209 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.466 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 . . . . . 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 120.839 0.352 . . . . 0.0 110.44 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 . . . . . 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 . . . . . 0 CA--C 1.52 -0.202 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.567 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.5 m120 . . . . . 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.2 t-20 . . . . . 0 C--O 1.232 0.161 0 CA-C-O 120.896 0.379 . . . . 0.0 111.527 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 . . . . . 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.9 t-20 . . . . . 0 N--CA 1.464 0.263 0 CA-C-O 120.546 0.212 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.533 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 . . . . . 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.941 0.401 . . . . 0.0 111.523 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 120.565 0.221 . . . . 0.0 110.662 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.425 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 . . . . . 0 CA--C 1.52 -0.2 0 CA-C-O 120.806 0.336 . . . . 0.0 110.857 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 62.4 mt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 110.226 -0.287 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.4 tpt180 -167.61 136.89 2.65 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.626 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -153.57 130.39 10.89 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 178.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.6 t -63.61 -23.44 67.38 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.026 179.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.8 t -64.35 -53.79 43.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.709 179.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.5 m -79.01 -23.83 44.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.088 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.683 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 22.9 t-20 -52.76 119.58 16.32 Favored Pre-proline 0 N--CA 1.463 0.201 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.183 -179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.496 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.2 Cg_endo -60.29 -45.87 20.84 Favored 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.594 2.196 . . . . 0.0 112.345 -179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.43 -46.02 88.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.369 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.683 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 52.5 t -60.67 -43.7 97.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.025 179.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 55.4 ttp85 -60.64 -39.41 88.18 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.844 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -70.01 -41.55 79.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-O 120.999 0.428 . . . . 0.0 110.842 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -72.11 -46.05 58.17 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.965 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.667 ' HB3' HG21 ' A' ' 18' ' ' VAL . 70.6 m-80 -120.51 87.78 2.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.661 -0.7 . . . . 0.0 111.025 -179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 56.91 27.85 13.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.9 178.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.667 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.2 t -79.6 -35.65 16.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.882 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 177.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 39.4 t . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 114.989 -1.005 . . . . 0.0 110.115 178.537 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 19.3 mm . . . . . 0 CA--C 1.529 0.138 0 CA-C-O 121.847 0.832 . . . . 0.0 109.936 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.495 ' O ' ' HB2' ' A' ' 6' ' ' CYS . 58.4 mmt-85 -75.2 -45.68 38.9 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.17 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -64.85 147.42 53.29 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.998 179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.5 t -52.39 -28.36 19.41 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.051 0.541 . . . . 0.0 111.737 -179.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 2' ' ' ARG . 5.7 t -60.84 -43.43 98.3 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.343 0.592 . . . . 0.0 110.227 179.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.7 m -90.84 -36.68 14.07 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.148 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -52.99 118.08 12.83 Favored Pre-proline 0 N--CA 1.464 0.238 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.513 -179.058 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.484 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.2 Cg_endo -66.3 -44.38 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.513 2.142 . . . . 0.0 112.548 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.66 -50.74 71.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.564 -0.289 . . . . 0.0 111.564 -179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 40.4 t -61.63 -42.96 99.62 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.765 0.317 . . . . 0.0 110.432 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.5 ttp180 -62.9 -36.28 82.84 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.773 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.3 t -72.56 -48.11 48.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-O 120.729 0.3 . . . . 0.0 110.659 179.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -65.59 -45.4 83.35 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.797 179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -120.42 99.31 6.49 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.822 179.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 38.2 t-80 59.52 32.41 21.64 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.599 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 7.2 t -78.72 -44.19 25.51 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.955 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 177.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 46.6 t . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.361 179.068 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.434 HG13 ' O ' ' A' ' 1' ' ' ILE . 10.7 tp . . . . . 0 CA--C 1.532 0.286 0 CA-C-O 122.565 1.174 . . . . 0.0 109.738 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -82.74 34.82 0.45 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.772 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -57.95 109.21 0.69 Allowed 'General case' 0 C--O 1.241 0.615 0 CA-C-O 121.28 0.562 . . . . 0.0 110.423 -179.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 37.1 t -62.71 -39.92 95.55 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.86 0.362 . . . . 0.0 111.031 -179.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.1 t -60.42 -45.0 95.19 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.207 0.527 . . . . 0.0 110.076 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.4 m -73.29 -39.79 65.07 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.961 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -65.81 118.42 51.55 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.495 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 29.6 Cg_endo -64.21 -42.79 16.71 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.393 2.062 . . . . 0.0 111.984 179.414 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -45.63 91.78 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.158 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.3 t -63.01 -45.34 92.8 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.0 ttm180 -56.5 -41.34 76.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.286 179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 76.9 t -70.62 -47.27 65.45 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.677 0.275 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -62.98 -49.8 73.28 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.076 0.465 . . . . 0.0 111.075 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -122.89 101.05 7.21 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.031 179.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 60.34 36.78 20.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.59 178.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 38.6 t -86.69 -49.95 14.5 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.011 0 N-CA-C 108.32 -0.993 . . . . 0.0 108.32 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 114.487 -1.233 . . . . 0.0 110.495 178.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 17.1 tt . . . . . 0 CA--C 1.533 0.298 0 CA-C-O 122.563 1.173 . . . . 0.0 109.605 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.9 ptm180 -66.96 -41.03 87.58 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.235 -1.348 . . . . 0.0 111.788 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -67.67 134.69 51.57 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.626 -178.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 19.7 t -78.66 4.35 13.89 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.553 0.692 . . . . 0.0 109.771 178.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.4 t -87.47 -56.01 3.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.525 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.4 ' HB2' ' CD2' ' A' ' 4' ' ' CGU . 7.2 m -82.04 -36.86 27.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.986 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 11.4 t-20 -54.9 114.25 6.68 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.643 -179.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.459 ' O ' HG23 ' A' ' 13' ' ' VAL . 22.3 Cg_exo -64.66 -41.0 20.51 Favored 'Trans proline' 0 N--CA 1.462 -0.333 0 C-N-CA 122.72 2.28 . . . . 0.0 111.884 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.51 -46.65 89.35 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.309 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.3 t -68.8 -44.93 72.53 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.743 -0.383 . . . . 0.0 110.241 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.3 ttt-85 -56.31 -38.95 71.98 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 112.099 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 9' ' ' PRO . 72.7 t -70.01 -48.99 59.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.717 0.294 . . . . 0.0 111.205 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.2 m-80 -67.38 -45.59 75.79 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.138 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -118.27 100.89 7.79 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.113 179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 40.8 t-80 59.71 36.0 22.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.66 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 26.0 t -84.3 -43.53 17.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 177.412 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 50.8 t . . . . . 0 C--N 1.322 -0.616 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.382 179.192 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.7 mm . . . . . 0 N--CA 1.455 -0.183 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -85.0 -41.97 15.32 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.751 0.31 . . . . 0.0 111.244 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 5' ' ' CYS . 3.4 p30 -82.83 166.18 19.2 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.536 -179.936 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.419 ' HB2' ' OD1' ' A' ' 3' ' ' ASP . 1.6 t -76.02 -14.71 60.22 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 107.869 -1.16 . . . . 0.0 107.869 178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.2 t -65.93 -58.14 6.25 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.871 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.8 m -83.9 36.97 0.58 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.315 0.578 . . . . 0.0 110.783 179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.64 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 18.9 t-20 -116.37 117.2 38.78 Favored Pre-proline 0 C--N 1.324 -0.509 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.212 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.477 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.1 Cg_exo -59.06 -45.14 29.69 Favored 'Trans proline' 0 N--CA 1.465 -0.161 0 C-N-CA 122.644 2.229 . . . . 0.0 111.928 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.79 -45.2 90.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.579 179.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.64 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -59.31 -46.66 87.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.083 179.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.552 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.1 tmt_? -59.11 -44.26 91.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.359 179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.477 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.4 t -65.89 -46.66 87.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-O 120.575 0.226 . . . . 0.0 111.109 -179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -64.68 -51.41 62.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.173 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.8 m-80 -122.23 104.33 9.38 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.597 179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 22.1 t-160 63.61 46.13 4.31 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 121.649 0.738 . . . . 0.0 111.178 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.2 t -106.73 -45.11 7.79 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.618 178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.5 t . . . . . 0 C--N 1.322 -0.598 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.903 179.444 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 25.6 pt . . . . . 0 N--CA 1.454 -0.254 0 CA-C-O 120.824 0.345 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.661 ' HE ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -170.65 -42.1 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.479 179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.661 ' HB2' ' HE ' ' A' ' 2' ' ' ARG . 0.9 OUTLIER -150.84 143.66 24.55 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.225 -0.898 . . . . 0.0 109.508 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.719 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -92.03 -26.42 18.35 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.43 -179.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.73 -57.86 8.66 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.707 0.289 . . . . 0.0 111.653 -179.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.8 m -75.11 -22.13 58.43 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.253 -179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.719 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 10.8 t-20 -56.02 120.09 31.44 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.751 -179.119 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.52 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.9 Cg_exo -62.42 -43.58 22.01 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.527 2.151 . . . . 0.0 111.814 179.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.58 -44.45 94.01 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.474 179.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.637 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 41.8 t -61.98 -44.31 97.0 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.8 ttp85 -60.98 -37.87 83.97 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.389 179.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 9' ' ' PRO . 74.5 t -68.96 -47.93 72.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 120.638 0.256 . . . . 0.0 110.946 -179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 72.7 m-80 -69.34 -43.12 74.33 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 120.981 0.419 . . . . 0.0 110.951 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.712 ' HB3' HG21 ' A' ' 18' ' ' VAL . 66.6 m-80 -118.94 91.22 3.5 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.615 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 76.0 t60 61.86 20.98 11.91 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.215 -0.902 . . . . 0.0 112.317 178.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.712 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.1 t -75.01 -36.89 39.84 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.899 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 177.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.864 179.059 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 68.1 mt . . . . . 0 N--CA 1.455 -0.212 0 N-CA-C 110.294 -0.261 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.407 HH12 ' CD1' ' A' ' 4' ' ' CGU . 49.7 ptt85 -82.97 128.96 34.95 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 116.484 -0.325 . . . . 0.0 110.36 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -91.97 116.77 29.2 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 179.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.407 ' CD1' HH12 ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -60.67 -28.9 68.96 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.026 -0.533 . . . . 0.0 109.921 179.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 4.8 t -64.89 -48.34 74.58 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.702 -0.681 . . . . 0.0 109.945 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -90.85 28.47 1.54 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.598 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.8 t-20 -126.98 113.36 21.94 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-O 120.734 0.302 . . . . 0.0 110.597 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.49 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.5 Cg_exo -62.63 -43.17 22.52 Favored 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.707 2.272 . . . . 0.0 112.166 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.57 -49.56 76.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.162 -179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.5 t -61.82 -43.73 98.27 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 179.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 43.3 tpt85 -55.63 -42.56 75.14 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.057 178.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 9' ' ' PRO . 75.2 t -69.97 -47.23 70.11 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.613 0.244 . . . . 0.0 111.173 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -62.45 -54.49 39.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.06 -179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.5 m120 -120.26 108.49 14.25 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.202 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.4 t60 64.37 30.2 13.29 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.18 -0.918 . . . . 0.0 111.88 179.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 29.7 t -78.26 -46.65 25.49 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t . . . . . 0 C--N 1.324 -0.519 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.19 178.858 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 34.2 pt . . . . . 0 N--CA 1.455 -0.222 0 CA-C-O 120.788 0.328 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.724 ' HG3' ' HG ' ' A' ' 4' ' ' CGU . 2.2 tpm_? -76.27 -66.21 0.83 Allowed 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 32.8 t70 41.89 63.42 1.33 Allowed 'General case' 0 N--CA 1.469 0.519 0 O-C-N 124.401 1.063 . . . . 0.0 113.27 178.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.724 ' HG ' ' HG3' ' A' ' 2' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 6.0 t -73.4 -12.81 60.94 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.945 -0.302 . . . . 0.0 111.45 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.4 ' HB3' OE21 ' A' ' 4' ' ' CGU . 6.8 t -80.18 -52.68 7.47 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.522 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.4 m -74.71 -44.15 51.46 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.813 -179.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 17.0 t-20 -57.76 119.45 33.63 Favored Pre-proline 0 N--CA 1.466 0.361 0 CA-C-O 120.938 0.399 . . . . 0.0 111.838 -178.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.526 ' O ' HG23 ' A' ' 13' ' ' VAL . 19.8 Cg_exo -65.69 -42.01 13.2 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.794 2.329 . . . . 0.0 111.918 179.559 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.68 -47.4 85.52 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.388 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 8.7 t -63.65 -43.83 95.61 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -56.88 -38.91 73.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.637 -0.71 . . . . 0.0 111.176 178.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.526 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.8 t -72.31 -47.19 54.03 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-O 120.72 0.295 . . . . 0.0 111.189 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 -65.67 -45.99 80.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.964 0.411 . . . . 0.0 110.883 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 63.5 m-80 -120.13 97.26 5.51 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.716 179.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.8 t-80 57.67 34.78 24.92 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.052 -0.976 . . . . 0.0 111.728 178.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -84.22 -39.18 14.43 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 177.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.33 179.302 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.51 ' HA ' ' CD2' ' A' ' 4' ' ' CGU . 13.4 mm . . . . . 0 C--O 1.235 0.298 0 CA-C-O 121.829 0.823 . . . . 0.0 109.688 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -90.42 -76.92 0.42 Allowed 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.187 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -142.26 38.57 1.57 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.962 0.887 . . . . 0.0 109.977 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.546 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.534 ' H ' ' CD2' ' A' ' 4' ' ' CGU . 1.6 t -91.03 -33.5 15.49 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.125 -0.943 . . . . 0.0 109.344 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.6 t -54.69 -63.19 1.23 Allowed 'General case' 0 CA--C 1.53 0.19 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.507 -179.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 75.2 m -88.91 39.08 0.91 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.305 0.574 . . . . 0.0 110.854 179.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.618 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 21.2 t-20 -109.91 124.61 33.13 Favored Pre-proline 0 C--N 1.324 -0.506 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.494 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.2 Cg_endo -56.8 -48.96 16.07 Favored 'Trans proline' 0 CA--C 1.529 0.257 0 C-N-CA 122.534 2.156 . . . . 0.0 112.782 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -47.9 81.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.813 0.339 . . . . 0.0 110.914 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.618 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 42.1 t -60.75 -43.24 98.22 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.38 179.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 54.1 ttt-85 -61.26 -39.71 91.38 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.076 179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.494 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -70.59 -43.43 77.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-O 120.808 0.337 . . . . 0.0 110.85 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -67.48 -48.79 66.13 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.03 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.664 ' HB3' HG21 ' A' ' 18' ' ' VAL . 6.3 m120 -121.62 89.86 3.2 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.726 179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 55.87 30.65 16.26 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.92 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.664 HG21 ' HB3' ' A' ' 15' ' ' ASN . 2.6 t -83.29 -39.54 15.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.016 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.3 t . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.009 178.487 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.408 ' N ' HD13 ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.781 0.324 . . . . 0.0 110.523 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.0 tpp85 -100.05 -31.2 11.55 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.208 0.528 . . . . 0.0 109.885 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -80.54 155.29 27.04 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.214 179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.527 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 1.3 t -87.71 -27.73 22.21 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.037 179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.448 ' HB3' OE21 ' A' ' 4' ' ' CGU . 9.7 t -60.94 -58.73 7.21 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.75 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -86.57 30.23 0.73 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.0 0.429 . . . . 0.0 110.833 179.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.749 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 23.2 t-20 -106.13 120.31 49.26 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.016 179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.468 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.8 Cg_endo -59.82 -45.52 24.36 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.558 2.172 . . . . 0.0 112.18 -179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -64.86 -46.37 82.13 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.683 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.749 ' HB3' ' HB3' ' A' ' 8' ' ' ASN . 43.6 t -57.75 -45.63 85.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.132 -0.485 . . . . 0.0 109.996 179.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.587 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 1.7 tmt_? -60.91 -44.29 97.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.615 179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -66.47 -51.18 60.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -63.28 -49.99 71.87 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.402 -179.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 6.7 m120 -121.57 103.08 8.66 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.289 0.566 . . . . 0.0 111.003 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 63.66 44.08 5.32 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.678 0.751 . . . . 0.0 111.235 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 53.9 t -102.9 -45.93 10.57 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.492 178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.322 -0.593 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.975 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 14.2 tt . . . . . 0 N--CA 1.455 -0.2 0 CA-C-O 120.831 0.348 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.0 ttm180 -71.5 127.59 33.07 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.461 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -71.06 115.29 10.02 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 108.099 -1.074 . . . . 0.0 108.099 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.572 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.459 ' H ' ' CD1' ' A' ' 4' ' ' CGU . 45.4 t -90.12 -32.77 16.52 Favored 'General case' 0 C--N 1.319 -0.748 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 9.5 t -66.56 -54.39 24.24 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.779 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 18.3 m -84.67 44.93 1.09 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.463 179.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.6 t-20 -143.86 118.04 6.0 Favored Pre-proline 0 C--N 1.327 -0.395 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.468 -179.508 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.476 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.1 Cg_exo -63.17 -44.48 15.17 Favored 'Trans proline' 0 N--CA 1.463 -0.307 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.89 -46.61 88.65 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.38 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -65.95 -40.09 91.03 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 179.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 ttt85 -61.11 -38.98 88.26 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.15 179.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.476 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.0 t -69.81 -47.17 71.56 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.784 0.326 . . . . 0.0 110.901 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.9 m-80 -66.75 -46.22 76.09 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.887 179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.6 m-80 -119.28 99.29 6.61 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.802 -0.636 . . . . 0.0 109.911 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.5 t-160 61.47 33.9 18.33 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.566 178.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 22.1 t -85.81 -46.18 16.95 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.581 177.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.637 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.403 HD13 ' N ' ' A' ' 1' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.233 0.236 0 CA-C-O 120.956 0.407 . . . . 0.0 110.607 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.533 HH11 ' HA ' ' A' ' 2' ' ' ARG . 3.2 tpp180 -91.5 66.83 5.49 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 121.26 0.553 . . . . 0.0 110.636 -179.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -81.57 129.16 34.58 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.642 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.46 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.4 t -69.35 -24.99 63.98 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.534 -0.757 . . . . 0.0 111.136 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.46 ' HB3' OE22 ' A' ' 4' ' ' CGU . 5.0 t -64.18 -43.97 93.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.035 0.445 . . . . 0.0 109.907 179.97 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 60.1 m -85.3 -36.38 20.88 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.31 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 16.5 t-20 -56.14 119.8 29.8 Favored Pre-proline 0 N--CA 1.466 0.359 0 CA-C-O 120.998 0.428 . . . . 0.0 112.113 -178.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.463 ' O ' HG23 ' A' ' 13' ' ' VAL . 12.6 Cg_exo -69.51 -43.21 3.01 Favored 'Trans proline' 0 N--CA 1.463 -0.27 0 C-N-CA 122.775 2.317 . . . . 0.0 111.693 179.19 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.72 -45.72 91.41 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.5 t -63.25 -42.22 99.16 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 179.297 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.4 ttm-85 -56.43 -44.68 80.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.439 179.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.463 HG23 ' O ' ' A' ' 9' ' ' PRO . 93.4 t -67.54 -48.86 75.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.426 -179.251 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -64.75 -48.62 73.88 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.488 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 -121.94 101.6 7.66 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.225 179.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.1 t60 63.44 28.47 15.44 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.127 -0.942 . . . . 0.0 111.996 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 6.4 t -74.94 -43.88 45.35 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 177.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 C--N 1.324 -0.54 0 CA-C-N 114.944 -1.026 . . . . 0.0 110.282 179.16 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.425 HG21 ' HB2' ' A' ' 5' ' ' CYS . 12.6 tt . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.817 0.341 . . . . 0.0 110.325 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 79.5 ttt180 -71.16 -38.45 72.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.077 -179.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 48.7 t0 -78.61 146.43 34.14 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.197 179.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.438 OE12 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.425 ' HB2' HG21 ' A' ' 1' ' ' ILE . 47.8 t -72.38 -23.34 61.1 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.777 -178.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.438 ' HB3' OE12 ' A' ' 4' ' ' CGU . 5.6 t -69.75 -48.42 59.4 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 49.7 m -75.08 -38.98 61.09 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.352 179.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -61.69 112.56 6.3 Favored Pre-proline 0 N--CA 1.466 0.374 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.432 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.466 ' O ' HG23 ' A' ' 13' ' ' VAL . 18.7 Cg_exo -65.21 -37.95 29.53 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.715 2.276 . . . . 0.0 111.859 179.331 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.04 -45.49 93.35 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.248 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.0 t -65.25 -44.06 89.33 Favored 'General case' 0 C--O 1.224 -0.247 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 178.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 41.6 mmm-85 -55.19 -40.36 70.65 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.071 178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 9' ' ' PRO . 85.5 t -74.58 -49.3 31.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -65.31 -46.6 79.71 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.929 0.395 . . . . 0.0 111.254 -179.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -120.24 98.7 6.19 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.335 179.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 19.7 t-160 61.28 30.94 19.39 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.892 178.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 20.2 t -82.7 -41.23 17.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.985 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 53.7 t . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 114.734 -1.121 . . . . 0.0 110.253 179.125 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.531 ' O ' ' HB3' ' A' ' 2' ' ' ARG . 66.1 mt . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' A' ' 1' ' ' ILE . 48.8 ttm-85 77.91 -36.14 0.21 Allowed 'General case' 0 N--CA 1.468 0.433 0 C-N-CA 123.481 0.712 . . . . 0.0 110.751 -179.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -81.58 156.43 25.19 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.148 179.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.515 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.0 t -91.86 -37.84 12.68 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.135 -0.484 . . . . 0.0 112.245 -179.497 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.471 ' HB3' OE12 ' A' ' 4' ' ' CGU . 7.5 t -65.91 -51.58 57.4 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 -179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.2 m -80.22 41.23 0.52 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.67 -0.696 . . . . 0.0 109.883 178.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 17.1 t-20 -143.42 116.66 5.98 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 33.5 Cg_endo -65.75 -40.08 18.4 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 122.165 1.91 . . . . 0.0 111.946 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.23 -49.34 74.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.239 179.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 t -60.28 -45.33 93.69 Favored 'General case' 0 C--N 1.332 -0.158 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -59.06 -38.1 78.59 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.3 179.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 60.1 t -73.28 -43.99 55.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-O 120.655 0.264 . . . . 0.0 110.881 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -63.72 -50.84 67.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.206 0.527 . . . . 0.0 110.544 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.748 HD22 HG21 ' A' ' 18' ' ' VAL . 1.2 p-10 -124.82 101.93 7.32 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.5 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 58.19 46.11 16.37 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 121.925 0.869 . . . . 0.0 111.267 178.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.748 HG21 HD22 ' A' ' 15' ' ' ASN . 51.5 t -103.65 -43.89 8.97 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.057 0 CA-C-N 115.065 -0.971 . . . . 0.0 109.388 178.308 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.3 t . . . . . 0 C--N 1.324 -0.534 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.219 179.057 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 49.6 mm . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 120.794 0.33 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.443 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 3.4 tpm_? -161.81 -10.69 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.04 179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -61.63 113.26 2.61 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.583 -0.895 . . . . 0.0 108.583 178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.7 t -65.81 -25.05 67.05 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.892 -0.594 . . . . 0.0 109.598 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.1 t -69.08 -45.57 69.96 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.1 m -95.57 30.57 2.25 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.217 -0.901 . . . . 0.0 110.788 179.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 25.7 t-20 -126.87 112.94 22.19 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-O 120.727 0.299 . . . . 0.0 110.468 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.567 ' O ' HG23 ' A' ' 13' ' ' VAL . 28.2 Cg_endo -63.67 -42.16 21.79 Favored 'Trans proline' 0 N--CA 1.461 -0.393 0 C-N-CA 122.357 2.038 . . . . 0.0 111.742 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.63 -47.31 81.85 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.096 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 30.2 t -61.48 -43.41 98.91 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 109.472 -0.566 . . . . 0.0 109.472 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.583 ' HD2' ' O ' ' A' ' 12' ' ' ARG . 3.3 tmm_? -57.81 -41.01 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.216 179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.1 t -63.47 -48.99 84.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 120.657 0.265 . . . . 0.0 110.9 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 -64.27 -50.71 66.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.09 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -121.57 106.52 11.46 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.386 179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 64.36 35.79 9.5 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.542 -0.754 . . . . 0.0 111.169 179.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -85.9 -41.38 15.25 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.949 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.433 177.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.1 t . . . . . 0 C--N 1.324 -0.533 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.155 179.607 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 21.4 pt . . . . . 0 N--CA 1.461 0.075 0 CA-C-O 121.592 0.71 . . . . 0.0 110.894 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -122.27 -49.59 2.04 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.14 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -83.81 42.17 0.84 Allowed 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.926 0.393 . . . . 0.0 110.959 -179.213 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.6 t -54.47 -22.94 14.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.866 -179.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 5.5 t -68.48 -45.47 72.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.175 0.512 . . . . 0.0 109.806 179.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.2 m -84.08 -35.47 23.72 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.064 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.2 t-20 -58.85 114.8 9.8 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.527 -178.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 21.4 Cg_exo -64.96 -42.73 13.59 Favored 'Trans proline' 0 N--CA 1.461 -0.401 0 C-N-CA 122.653 2.235 . . . . 0.0 111.866 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.71 -46.29 90.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.114 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.1 t -64.88 -45.02 87.73 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.932 -0.396 . . . . 0.0 109.932 179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.8 ttt-85 -58.33 -38.89 78.05 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.819 179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.6 t -69.62 -48.2 66.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-O 120.603 0.24 . . . . 0.0 111.17 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 63.7 m-80 -66.28 -46.34 77.35 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.122 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 73.7 m-80 -120.37 98.48 6.07 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.269 179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 72.7 t60 63.3 27.38 15.41 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.987 178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 3.0 t -75.19 -41.12 44.26 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 52.8 t . . . . . 0 C--N 1.323 -0.554 0 CA-C-N 115.044 -0.98 . . . . 0.0 110.429 179.238 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.554 HG23 ' HB3' ' A' ' 4' ' ' CGU . 64.9 mt . . . . . 0 N--CA 1.456 -0.125 0 N-CA-C 110.326 -0.249 . . . . 0.0 110.326 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.4 mmt85 -88.05 -63.08 1.35 Allowed 'General case' 0 N--CA 1.445 -0.693 0 N-CA-C 110.084 -0.339 . . . . 0.0 110.084 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -154.05 22.14 0.5 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 123.029 1.395 . . . . 0.0 109.252 177.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.554 ' HB3' HG23 ' A' ' 1' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 5.4 t -55.92 -24.58 38.55 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.525 -1.216 . . . . 0.0 111.296 179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 7.8 t -61.9 -47.1 86.48 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.183 0.516 . . . . 0.0 110.239 179.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 25.7 t -92.97 -31.14 15.01 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.334 -179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 16.9 t-20 -62.23 113.91 10.12 Favored Pre-proline 0 N--CA 1.464 0.263 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.194 -178.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.533 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.6 Cg_exo -64.29 -46.76 7.12 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.791 2.327 . . . . 0.0 112.515 -179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.59 -49.01 79.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.065 -179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 46.2 t -64.24 -43.27 95.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.291 179.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.0 ttt-85 -57.33 -36.79 71.58 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.225 179.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.533 HG23 ' O ' ' A' ' 9' ' ' PRO . 70.5 t -67.21 -50.09 66.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 120.759 0.314 . . . . 0.0 110.626 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -66.54 -46.38 76.3 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.212 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 60.2 m-80 -119.0 102.42 8.74 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.56 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 71.7 t60 62.27 30.88 17.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.778 178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 13.2 t -76.82 -45.34 31.87 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 177.259 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 22.3 t . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.492 179.169 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . 0.429 HG12 ' H ' ' A' ' 3' ' ' ASP . 14.2 tt . . . . . 0 N--CA 1.455 -0.213 0 CA-C-O 120.778 0.323 . . . . 0.0 110.181 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 53.7 mtp85 -78.2 -31.53 49.51 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.378 -0.373 . . . . 0.0 111.428 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.429 ' H ' HG12 ' A' ' 1' ' ' ILE . 29.5 t70 -81.36 136.06 35.71 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.648 -179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.522 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.0 t -71.17 -27.75 63.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.592 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.522 ' HB3' OE22 ' A' ' 4' ' ' CGU . 8.5 t -65.09 -52.73 53.84 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 33.6 t -67.55 -42.4 82.72 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.676 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -58.96 117.52 21.97 Favored Pre-proline 0 N--CA 1.462 0.167 0 CA-C-N 116.301 -0.408 . . . . 0.0 111.523 -179.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.474 ' O ' HG23 ' A' ' 13' ' ' VAL . 35.8 Cg_endo -66.51 -42.64 9.26 Favored 'Trans proline' 0 N--CA 1.46 -0.467 0 C-N-CA 122.415 2.077 . . . . 0.0 111.944 179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.04 -45.3 92.94 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.106 179.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.3 t -63.23 -44.34 95.52 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.511 -0.551 . . . . 0.0 109.511 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.3 ttm180 -58.57 -40.56 83.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.459 179.18 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.3 t -71.09 -47.74 59.47 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.701 0.286 . . . . 0.0 111.356 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -66.79 -45.13 79.42 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.937 0.398 . . . . 0.0 111.068 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.2 m-80 -119.52 96.27 5.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.921 -0.582 . . . . 0.0 109.986 179.217 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 36.2 t-80 60.54 29.69 19.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 111.663 178.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 5.4 t -81.52 -39.24 16.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.002 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 177.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 41.2 t . . . . . 0 C--N 1.322 -0.615 0 CA-C-N 114.566 -1.197 . . . . 0.0 110.415 179.196 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 11.9 tt . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 120.726 0.298 . . . . 0.0 110.464 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.403 ' HG2' ' N ' ' A' ' 3' ' ' ASP . 28.9 ttt-85 -169.56 150.97 4.23 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.023 179.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.403 ' N ' ' HG2' ' A' ' 2' ' ' ARG . 9.7 p-10 -73.1 160.88 31.33 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.951 178.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.501 OE22 ' HB3' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -69.43 -30.03 67.88 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.018 179.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.501 ' HB3' OE22 ' A' ' 4' ' ' CGU . 9.0 t -63.06 -53.5 52.77 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.276 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 59.5 m -70.52 -34.22 72.05 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.275 179.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 29.8 t-20 -59.16 115.61 12.78 Favored Pre-proline 0 N--CA 1.464 0.26 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.662 -179.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.425 ' O ' HG23 ' A' ' 13' ' ' VAL . 31.8 Cg_exo -60.0 -47.02 16.55 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.647 2.232 . . . . 0.0 112.237 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.72 -46.12 86.84 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.235 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.7 t -61.45 -42.4 98.7 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 39.4 ttt85 -64.07 -37.22 86.65 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.842 179.297 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 9' ' ' PRO . 55.9 t -72.68 -46.47 54.09 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.239 0 CA-C-O 120.725 0.298 . . . . 0.0 110.745 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -66.12 -45.2 81.96 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.622 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -120.64 95.16 4.61 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.044 179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 77.1 t60 65.57 15.01 9.83 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.671 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 2.2 t -68.35 -41.52 83.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.612 0.72 . . . . 0.0 109.48 177.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.323 -0.569 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.569 179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ILE . . . . . . . . . . . . . 4.1 mp . . . . . 0 C--O 1.232 0.177 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -169.31 130.8 1.14 Allowed 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.894 -0.41 . . . . 0.0 109.894 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.465 ' HB3' ' CB ' ' A' ' 6' ' ' CYS . 8.4 t70 67.8 121.58 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.444 0 O-C-N 124.096 0.872 . . . . 0.0 110.473 -179.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CGU . . . . . 0.644 ' O ' ' HB2' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 41.9 t -74.97 -40.57 60.66 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.782 0.325 . . . . 0.0 110.853 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.465 ' CB ' ' HB3' ' A' ' 3' ' ' ASP . 7.7 t -60.46 -49.22 78.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.239 0.542 . . . . 0.0 109.968 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.0 m -87.46 44.9 1.22 Allowed 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.004 178.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.644 ' HB2' ' O ' ' A' ' 4' ' ' CGU . 13.6 t-20 -144.52 116.98 5.51 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.857 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.483 ' O ' HG23 ' A' ' 13' ' ' VAL . 24.2 Cg_exo -63.09 -42.82 21.53 Favored 'Trans proline' 0 N--CA 1.463 -0.322 0 C-N-CA 122.585 2.19 . . . . 0.0 111.742 179.487 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.96 -48.32 79.4 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.39 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.4 t -61.24 -43.22 99.24 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 179.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD3' ' O ' ' A' ' 12' ' ' ARG . 2.4 tmt_? -57.77 -44.63 86.34 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.049 178.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 9' ' ' PRO . 73.5 t -66.48 -45.34 89.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.692 0.282 . . . . 0.0 110.971 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -62.02 -55.15 32.18 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.022 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -124.91 108.39 11.84 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.395 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HYP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 42.0 t-80 62.24 37.79 13.89 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.398 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 24.7 t -88.03 -45.65 15.89 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.989 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 43.9 t . . . . . 0 C--N 1.323 -0.56 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.303 179.058 . . . . . . . . 0 0 . 1 stop_ save_