data_2kkj_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 2kkj _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 5' ' ' ILE . . . . . 0.429 HD13 HD13 ' A' ' 10' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.422 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.591 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.684 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.684 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.606 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.547 ' HA ' ' ND2' ' A' ' 36' ' ' ASN . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.547 ' ND2' ' HA ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.481 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.483 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.662 0.268 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.707 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.547 HD11 HG11 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.547 HG11 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.411 HD11 ' HE2' ' A' ' 40' ' ' MET . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.655 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m . . . . . 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.427 HD13 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.491 ' O ' HG21 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.491 HG21 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.513 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 4.0 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.547 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.833 HE21 ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.644 HG21 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 1.014 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.748 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 1.014 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.625 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.959 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.959 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.845 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.413 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m . . . . . 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 35' ' ' SER . 30.2 mm . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.441 ' HA ' HE21 ' A' ' 11' ' ' GLN . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HB2' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.581 ' HA ' HD21 ' A' ' 14' ' ' LEU . 28.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.671 ' HB2' HG22 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.581 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.518 HD23 HG22 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.581 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 38.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.458 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 6.9 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.548 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 3.1 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.548 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.591 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HA ' HD21 ' A' ' 33' ' ' LEU . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.671 HG22 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 1.029 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' HD11 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.695 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 1.029 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.987 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.987 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HB2' ' NZ ' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.443 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.443 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 60.6 m . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.998 0.427 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.491 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.797 HD13 HG11 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.659 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.572 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.797 HG11 HD13 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.668 HD11 HD11 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.668 HD11 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.648 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.439 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.581 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.581 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m . . . . . 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.536 HD11 HG12 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.466 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.709 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.709 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 26.4 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.406 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.536 HG12 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.453 HD11 HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.771 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.7 m . . . . . 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 C--O 1.235 0.322 0 CA-C-O 120.817 0.341 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.596 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.722 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.94 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.578 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 1.06 ' HB2' HD12 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.94 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.473 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.998 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.823 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 6.3 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 2.2 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.521 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.998 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 1.06 HD12 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.805 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.428 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.596 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.669 HD13 HD12 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.805 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.499 HG22 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt . . . . . 0 N--CA 1.454 -0.272 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.721 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.73 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.639 HG21 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 18' ' ' LYS . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.909 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.909 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.482 ' HA ' HE21 ' A' ' 28' ' ' GLN . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.648 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.639 ' HB3' HG21 ' A' ' 16' ' ' THR . 2.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.515 ' O ' HD22 ' A' ' 33' ' ' LEU . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' HE1' ' A' ' 40' ' ' MET . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.987 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.728 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 27.6 t-20 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.987 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.63 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.759 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.759 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.601 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.681 HD13 HG23 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.645 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.555 HG23 ' N ' ' A' ' 17' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 1.019 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 1.029 ' HB2' ' HB3' ' A' ' 24' ' ' GLN 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.645 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.993 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 1.029 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.665 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.714 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 8.1 mm100 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.665 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.723 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.432 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.723 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.483 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HZ1' ' HB3' ' A' ' 45' ' ' LYS . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . 0.416 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 6.9 tp-100 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.708 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.81 HD12 HG11 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.459 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.57 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.532 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . 0.65 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 26.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLN . . . . . 0.65 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 58.7 tp60 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . 0.81 HG11 HD12 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.742 HG23 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.616 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 1.023 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLN . . . . . 0.602 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' MET . . . . . 0.842 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.476 0.475 0 N-CA-C 110.442 -0.638 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -96.44 -11.77 25.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.348 0.594 . . . . 0.0 109.925 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -137.27 72.45 1.42 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.294 176.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -92.37 54.01 2.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.558 0.694 . . . . 0.0 110.132 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.429 HD13 HD13 ' A' ' 10' ' ' LEU . 20.9 pt -105.04 149.55 8.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.568 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.422 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.617 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.617 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.591 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.684 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.684 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.606 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.606 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.547 ' HA ' ' ND2' ' A' ' 36' ' ' ASN . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.547 ' ND2' ' HA ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.481 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.483 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m 66.44 -82.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.44 14.36 5.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 111.703 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -93.66 139.64 30.56 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.97 87.7 4.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.431 0.634 . . . . 0.0 110.588 -174.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 29.9 m -102.31 9.81 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.637 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.16 56.99 3.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.448 0.642 . . . . 0.0 110.511 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -120.12 100.54 7.25 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.701 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -110.52 136.4 20.62 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.23 48.3 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.106 2.537 . . . . 0.0 113.072 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -130.14 2.31 5.86 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.8 mmt -87.91 139.34 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.079 178.604 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.474 0.348 0 N-CA-C 110.397 -0.655 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -65.03 -34.98 79.74 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.415 HH11 ' HD2' ' A' ' 3' ' ' ARG . 64.9 mtt180 70.02 13.71 7.85 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.397 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.8 t -121.58 -40.88 2.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.867 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt -69.57 139.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.698 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.443 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.707 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.529 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.547 HD11 HG11 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.707 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.526 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.526 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.416 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.547 HG11 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.411 HD11 ' HE2' ' A' ' 40' ' ' MET . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.655 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.512 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.551 ' HA ' ' HB ' ' A' ' 52' ' ' VAL . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.512 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m 70.2 -67.71 0.23 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -172.18 36.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -104.12 97.44 7.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.532 -176.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 75.0 -35.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.904 0.881 . . . . 0.0 112.277 173.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.551 ' HB ' ' HA ' ' A' ' 46' ' ' GLN . 12.0 t -86.75 57.46 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-O 121.646 0.736 . . . . 0.0 110.728 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 142.85 30.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.12 58.41 1.55 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 0.0 110.995 -168.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.459 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -97.27 118.64 64.34 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 170.807 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 6.3 Cg_endo -86.84 5.99 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 123.167 2.578 . . . . 0.0 112.156 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.24 -52.14 0.84 Allowed Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 57.0 ttp -78.67 134.96 37.08 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.086 -179.931 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.48 0.68 0 CA-C-O 120.445 0.102 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -82.79 -12.48 57.46 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 -171.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.421 HH11 ' HD2' ' A' ' 3' ' ' ARG . 46.5 ttm180 -112.89 125.96 54.94 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.316 -0.24 . . . . 0.0 111.254 -176.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t 75.02 155.43 0.17 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.803 0.811 . . . . 0.0 112.323 173.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.427 HD13 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp -93.76 131.68 40.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.148 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.491 ' O ' HG21 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.491 HG21 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.513 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.513 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.474 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 4.0 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.547 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.833 HE21 ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.516 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.498 ' HA ' ' HE2' ' A' ' 40' ' ' MET . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.644 HG21 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 1.014 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.748 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 1.014 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.625 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.404 ' N ' ' O ' ' A' ' 37' ' ' PRO . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.959 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.959 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.845 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.413 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m 70.06 117.85 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.3 82.11 0.24 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.102 -175.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -93.72 -29.06 15.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.816 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.417 ' HD1' HG22 ' A' ' 52' ' ' VAL . 11.5 p90 -144.61 161.66 38.59 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -176.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.417 HG22 ' HD1' ' A' ' 51' ' ' TYR . 54.6 t 66.6 -79.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.858 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.51 58.69 4.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.074 0.464 . . . . 0.0 110.433 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -64.23 -33.14 75.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.69 -178.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 3.9 pt20 -83.54 123.83 76.13 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.966 174.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 3.4 Cg_exo -77.67 7.13 4.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.249 2.632 . . . . 0.0 113.367 -174.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 166.11 -162.25 35.81 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.226 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.833 ' HG3' ' HG2' ' A' ' 59' ' ' GLN . 54.7 tpp -81.1 138.0 35.95 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.833 ' HG2' ' HG3' ' A' ' 58' ' ' MET . 15.9 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.401 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.79 -0.504 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -166.05 163.02 18.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -92.33 49.84 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.823 0.821 . . . . 0.0 109.732 -178.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.0 m -153.14 125.8 8.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.08 -0.964 . . . . 0.0 108.508 178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.472 HD11 ' O ' ' A' ' 35' ' ' SER . 30.2 mm -69.19 114.61 6.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 -173.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.441 ' HA ' HE21 ' A' ' 11' ' ' GLN . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.657 ' HB2' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.581 ' HA ' HD21 ' A' ' 14' ' ' LEU . 28.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.671 ' HB2' HG22 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.581 HD21 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.427 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.581 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.518 HD23 HG22 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.468 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.468 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.581 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 38.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.458 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 6.9 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.548 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 3.1 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.548 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.591 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' HA ' HD21 ' A' ' 33' ' ' LEU . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.671 HG22 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 1.029 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.472 ' O ' HD11 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.695 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 1.029 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.987 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.987 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.449 ' HB2' ' NZ ' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.443 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.91 HG21 ' HD1' ' A' ' 51' ' ' TYR . 60.6 m 80.06 125.34 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.4 47.2 0.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.5 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -147.25 -66.2 0.27 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.91 ' HD1' HG21 ' A' ' 48' ' ' THR . 81.1 m-85 -61.78 140.98 58.18 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.1 m -86.21 48.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.221 0.534 . . . . 0.0 111.052 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.93 -22.31 65.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.963 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -72.22 -32.36 66.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.059 0.457 . . . . 0.0 110.541 176.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.403 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 64.6 tt0 -77.73 124.04 86.47 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.98 -175.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 66.3 Cg_endo -92.53 135.74 1.42 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 123.141 2.561 . . . . 0.0 112.624 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -93.6 47.81 2.32 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.492 ' O ' ' HB2' ' A' ' 59' ' ' GLN . 78.1 mtp -88.45 122.26 31.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -173.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.492 ' HB2' ' O ' ' A' ' 58' ' ' MET . 10.5 tt0 . . . . . 0 C--O 1.243 0.73 0 O-C-N 124.579 1.175 . . . . 0.0 108.63 169.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.478 0.582 0 N-CA-C 110.182 -0.738 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.2 m120 58.53 -151.69 0.42 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.579 0.55 . . . . 0.0 110.031 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? 76.21 -38.12 0.32 Allowed 'General case' 0 N--CA 1.471 0.6 0 O-C-N 123.669 0.605 . . . . 0.0 111.17 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -65.43 128.34 35.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.347 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt -93.84 149.8 4.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.472 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.491 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.797 HD13 HG11 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.659 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.413 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.659 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.528 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.572 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.797 HG11 HD13 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.668 HD11 HD11 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.668 HD11 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.648 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.439 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.581 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.581 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m 29.64 85.6 0.01 OUTLIER 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.91 91.26 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.212 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -92.57 -81.9 0.34 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -97.16 11.9 34.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.924 0.393 . . . . 0.0 111.756 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -98.44 10.84 6.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.927 0.394 . . . . 0.0 110.684 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.41 -177.16 0.14 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.703 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -141.17 30.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.941 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.458 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 41.2 mt-30 -93.37 131.35 32.91 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.912 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 13.8 Cg_exo -70.3 97.27 0.67 Allowed 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.923 2.416 . . . . 0.0 112.198 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -91.84 -174.38 42.67 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.811 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 51.2 ttm -65.99 122.64 17.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.981 0.42 . . . . 0.0 110.415 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.054 -179.03 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo . . . . . 0 N--CA 1.482 0.814 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -61.9 -47.94 82.7 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.559 0.219 . . . . 0.0 110.865 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -142.44 -47.38 0.34 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.555 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.5 m -150.64 157.39 42.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.5 0.191 . . . . 0.0 110.899 -176.227 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt -91.25 126.94 43.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 170.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.536 HD11 HG12 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.466 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.498 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.709 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.709 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.415 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 26.4 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.406 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.536 HG12 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.771 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.659 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.453 HD11 HD12 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.771 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.408 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.7 m 72.09 -67.17 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -178.32 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.143 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.968 ' HA ' ' HE3' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -120.48 -53.63 2.1 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.311 -178.383 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -88.51 -33.61 17.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.291 0.567 . . . . 0.0 109.765 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.18 94.25 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.781 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -127.94 -63.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.064 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -159.75 -58.43 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.533 -176.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.458 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 8.5 tp-100 -92.52 123.25 62.55 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -173.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.458 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 14.7 Cg_endo -90.64 151.01 4.21 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.233 2.622 . . . . 0.0 111.611 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.11 83.33 1.19 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.326 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.415 ' O ' ' HB3' ' A' ' 59' ' ' GLN . 28.1 ttt -65.54 141.43 58.46 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.415 ' HB3' ' O ' ' A' ' 58' ' ' MET . 56.1 tt0 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.235 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.919 -0.454 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -112.39 -40.13 4.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.804 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -85.8 101.97 13.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.703 -174.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.0 m 61.44 65.87 0.92 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.68 137.93 23.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.76 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.596 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.722 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.94 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.578 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 1.06 ' HB2' HD12 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.94 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.578 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.473 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.998 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.823 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 6.3 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.463 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 2.2 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.521 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.998 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 1.06 HD12 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.805 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.428 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.596 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.428 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.669 HD13 HD12 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.805 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.463 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.431 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.431 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p -78.42 46.79 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.691 ' HB3' ' HB ' ' A' ' 52' ' ' VAL . . . -77.09 -46.03 24.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.425 -167.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.467 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 4.3 ttmp? 67.48 88.35 0.11 Allowed 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.41 0.444 . . . . 0.0 110.664 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.401 ' HD2' ' HG2' ' A' ' 50' ' ' LYS . 97.3 m-85 66.05 57.0 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.213 178.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . 0.691 ' HB ' ' HB3' ' A' ' 49' ' ' ALA . 9.8 p -97.05 -16.17 7.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.1 82.0 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.824 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -68.6 -32.69 72.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.379 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -85.96 133.28 41.57 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.572 178.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.65 -1.09 10.78 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.654 2.236 . . . . 0.0 111.543 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.17 -100.06 2.04 Favored Glycine 0 N--CA 1.447 -0.624 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.807 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -85.7 135.92 33.57 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.553 177.615 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 110.736 -0.524 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -109.26 99.58 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.616 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 67.42 -68.95 0.14 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.958 0.903 . . . . 0.0 111.47 -178.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.6 t -82.85 111.47 18.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.499 HG22 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt -70.95 121.77 21.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.721 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.721 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.465 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.73 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.639 HG21 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.672 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.4 ' HA ' ' HD2' ' A' ' 18' ' ' LYS . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.909 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.909 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.482 ' HA ' HE21 ' A' ' 28' ' ' GLN . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.648 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.639 ' HB3' HG21 ' A' ' 16' ' ' THR . 2.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.515 ' O ' HD22 ' A' ' 33' ' ' LEU . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.419 ' HA ' ' HE1' ' A' ' 40' ' ' MET . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.73 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.987 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.728 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 27.6 t-20 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.987 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.63 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.441 ' O ' HD12 ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.759 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.759 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m -76.42 160.91 29.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.29 37.21 11.19 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.032 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -63.02 -17.89 62.72 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.263 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -66.72 -27.27 67.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.372 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.45 -40.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.73 -91.35 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 122.872 0.469 . . . . 0.0 110.18 -172.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -131.93 -18.18 2.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.134 0.492 . . . . 0.0 110.54 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -112.78 121.68 37.96 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.154 -175.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.06 140.46 95.32 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.65 2.233 . . . . 0.0 111.449 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -115.5 45.94 1.23 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.72 -175.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 94.1 mmm -80.39 121.77 26.12 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.553 -0.737 . . . . 0.0 109.358 177.464 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.027 -0.413 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.416 ' O ' ' HB3' ' A' ' 3' ' ' ARG . 7.3 t-20 60.24 -152.02 0.4 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.416 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 39.0 ttm180 71.67 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 122.887 0.475 . . . . 0.0 110.315 -177.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 p -88.53 126.49 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt -62.22 131.88 27.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.601 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.407 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.681 HD13 HG23 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.645 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.555 HG23 ' N ' ' A' ' 17' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 1.019 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 1.029 ' HB2' ' HB3' ' A' ' 24' ' ' GLN 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.645 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.993 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.771 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 1.029 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.665 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.714 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 8.1 mm100 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.665 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.54 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.681 HG23 HD13 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.723 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.432 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.432 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.723 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.483 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.547 ' HZ1' ' HB3' ' A' ' 45' ' ' LYS . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . 0.416 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 6.9 tp-100 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 0.483 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m 53.51 83.24 0.07 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 62.59 10.03 3.85 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.965 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.675 ' HB2' ' HZ2' ' A' ' 50' ' ' LYS . 10.0 mtmp? -133.93 61.21 1.68 Allowed 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -87.02 69.65 10.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.344 -0.844 . . . . 0.0 108.8 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 t 59.21 39.07 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 122.467 1.127 . . . . 0.0 108.533 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -139.48 167.07 22.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.885 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -132.84 109.5 9.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.242 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.474 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 4.7 tt0 -91.62 122.97 64.89 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.236 173.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.474 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 7.7 Cg_exo -73.99 46.4 1.31 Allowed 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.149 2.566 . . . . 0.0 112.527 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -163.44 175.77 39.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -85.32 139.37 31.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.67 0.235 . . . . 0.0 110.966 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 . . . . . 0 C--O 1.251 1.135 0 O-C-N 124.069 0.856 . . . . 0.0 111.653 177.65 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.476 0.458 0 N-CA-C 110.353 -0.672 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -122.92 -64.88 1.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.224 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 3' ' ' ARG . 32.6 mmt180 62.51 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 O-C-N 124.101 0.876 . . . . 0.0 112.696 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.8 p -73.78 106.12 5.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.156 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.07 125.19 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.708 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.492 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.81 HD12 HG11 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.708 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.492 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.459 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.57 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.532 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . 0.532 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . 0.65 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 26.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLN . . . . . 0.65 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 58.7 tp60 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . 0.81 HG11 HD12 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.742 HG23 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 1.023 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.616 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 1.023 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.602 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.419 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' MET . . . . . 0.842 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m 55.63 39.1 30.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.41 62.32 6.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.782 -176.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.602 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 10.7 mtmp? -103.2 113.87 27.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.6 4.3 19.01 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.5 t 67.22 102.21 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.609 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.39 149.65 22.19 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.558 174.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -74.96 62.86 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.059 0.456 . . . . 0.0 111.043 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -110.63 120.94 42.55 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.86 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_exo -71.84 68.75 3.03 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 122.929 2.419 . . . . 0.0 112.149 178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.47 146.88 18.36 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.817 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 83.4 mtp -87.66 123.57 32.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.9 0.381 . . . . 0.0 110.458 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.648 -0.691 . . . . 0.0 109.59 -179.325 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.446 HD12 HD11 ' A' ' 10' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.603 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.628 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.61 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 40' ' ' MET . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.403 ' OD1' ' HA ' ' A' ' 33' ' ' LEU . 12.0 p30 -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.474 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.497 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.662 0.268 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.531 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.4 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.568 HG13 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m . . . . . 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.436 HD12 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.492 ' O ' HG22 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.479 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.489 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 11.2 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.532 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.479 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 7.1 tp60 -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.488 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.763 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.601 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.963 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 38' ' ' GLN . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.963 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.452 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m . . . . . 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.486 HD12 ' O ' ' A' ' 35' ' ' SER . 30.2 mm . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 14' ' ' LEU . 3.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.426 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.687 ' HB2' HG21 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.546 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.558 HD23 HG21 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.489 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.546 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 41.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 40.4 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 7.3 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.687 HG21 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 1.034 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.486 ' O ' HD12 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.709 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 1.034 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.512 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.994 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.994 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' NZ ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 60.6 m . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.998 0.427 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.494 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.771 HD11 HG13 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.666 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.543 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.574 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.62 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.62 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m . . . . . 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.648 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.562 HD11 HG13 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.459 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.711 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.711 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 85.8 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.562 HG13 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.681 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 HD11 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 61.7 m . . . . . 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 C--O 1.235 0.322 0 CA-C-O 120.817 0.341 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.637 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.743 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.952 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 1.051 ' HB2' HD11 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.952 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.982 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.848 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 43.1 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 17.8 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.982 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 1.051 HD11 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.82 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.449 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.637 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.82 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.513 HG21 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt . . . . . 0 N--CA 1.454 -0.272 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.727 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.479 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.744 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.615 HG22 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.918 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.918 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.652 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.615 ' HB3' HG22 ' A' ' 16' ' ' THR . 22.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.53 HG22 ' CB ' ' A' ' 16' ' ' THR . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.967 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.741 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 7.3 t30 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.967 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.604 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.466 HD13 ' O ' ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.78 ' HB2' HD12 ' A' ' 33' ' ' LEU . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.509 HD11 ' HE3' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 47' ' ' ARG . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.726 HD12 HG22 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 13' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 1.022 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 1.039 ' HB3' ' HB2' ' A' ' 22' ' ' SER 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . 1.039 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.807 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 1.021 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.671 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.789 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 50.5 mm-40 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.671 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.726 HG22 HD12 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.736 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.446 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.736 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.498 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.454 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 54.0 tp60 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.454 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 6' ' ' SER . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.499 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.831 HD11 HG13 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.462 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.58 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 4.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLN . . . . . 0.661 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 7.9 tp-100 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.831 HG13 HD11 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.635 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' MET . . . . . 0.841 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.46 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.476 0.475 0 N-CA-C 110.442 -0.638 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -96.44 -11.77 25.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.348 0.594 . . . . 0.0 109.925 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 24.6 mtp85 -137.27 72.45 1.42 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.294 176.482 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -92.37 54.01 2.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.558 0.694 . . . . 0.0 110.132 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.446 HD12 HD11 ' A' ' 10' ' ' LEU . 20.9 pt -105.04 149.55 8.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.568 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.603 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.628 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.61 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.474 ' HB3' ' HB2' ' A' ' 40' ' ' MET . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.403 ' OD1' ' HA ' ' A' ' 33' ' ' LEU . 12.0 p30 -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.474 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.497 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 96.7 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m 66.44 -82.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.44 14.36 5.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 111.703 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -93.66 139.64 30.56 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.97 87.7 4.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.431 0.634 . . . . 0.0 110.588 -174.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 29.9 m -102.31 9.81 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.637 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.16 56.99 3.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.448 0.642 . . . . 0.0 110.511 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -120.12 100.54 7.25 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.701 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -110.52 136.4 20.62 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.23 48.3 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.106 2.537 . . . . 0.0 113.072 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -130.14 2.31 5.86 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.8 mmt -87.91 139.34 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.079 178.604 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.474 0.348 0 N-CA-C 110.397 -0.655 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -65.03 -34.98 79.74 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 3' ' ' ARG . 64.9 mtt180 70.02 13.71 7.85 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.397 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.8 t -121.58 -40.88 2.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.867 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt -69.57 139.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.698 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.531 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 28.4 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.568 HG13 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.582 ' HA ' ' HB ' ' A' ' 52' ' ' VAL . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m 70.2 -67.71 0.23 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -172.18 36.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -104.12 97.44 7.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.532 -176.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 75.0 -35.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.904 0.881 . . . . 0.0 112.277 173.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.582 ' HB ' ' HA ' ' A' ' 46' ' ' GLN . 12.0 t -86.75 57.46 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-O 121.646 0.736 . . . . 0.0 110.728 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 142.85 30.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -97.12 58.41 1.55 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 0.0 110.995 -168.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 15.9 mp0 -97.27 118.64 64.34 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 170.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 6.3 Cg_endo -86.84 5.99 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 123.167 2.578 . . . . 0.0 112.156 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.24 -52.14 0.84 Allowed Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 57.0 ttp -78.67 134.96 37.08 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.086 -179.931 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.48 0.68 0 CA-C-O 120.445 0.102 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -82.79 -12.48 57.46 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 -171.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 3' ' ' ARG . 46.5 ttm180 -112.89 125.96 54.94 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.316 -0.24 . . . . 0.0 111.254 -176.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t 75.02 155.43 0.17 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.803 0.811 . . . . 0.0 112.323 173.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.436 HD12 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp -93.76 131.68 40.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.148 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.492 ' O ' HG22 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.479 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.489 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 11.2 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.532 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.479 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 7.1 tp60 -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.488 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.763 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.601 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.963 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 38' ' ' GLN . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.963 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.452 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m 70.06 117.85 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.3 82.11 0.24 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.102 -175.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -93.72 -29.06 15.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.816 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HD1' HG23 ' A' ' 52' ' ' VAL . 11.5 p90 -144.61 161.66 38.59 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -176.537 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG23 ' HD1' ' A' ' 51' ' ' TYR . 54.6 t 66.6 -79.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.858 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.51 58.69 4.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.074 0.464 . . . . 0.0 110.433 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -64.23 -33.14 75.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.69 -178.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 12.2 pt20 -83.54 123.83 76.13 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.966 174.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 3.4 Cg_exo -77.67 7.13 4.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.249 2.632 . . . . 0.0 113.367 -174.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 166.11 -162.25 35.81 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.226 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.855 ' HG3' ' HG2' ' A' ' 59' ' ' GLN . 54.7 tpp -81.1 138.0 35.95 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.855 ' HG2' ' HG3' ' A' ' 58' ' ' MET . 15.9 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.401 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.79 -0.504 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -166.05 163.02 18.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -92.33 49.84 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.823 0.821 . . . . 0.0 109.732 -178.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.0 m -153.14 125.8 8.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.08 -0.964 . . . . 0.0 108.508 178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.486 HD12 ' O ' ' A' ' 35' ' ' SER . 30.2 mm -69.19 114.61 6.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 -173.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 14' ' ' LEU . 3.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.426 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.687 ' HB2' HG21 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.546 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.558 HD23 HG21 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.546 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 41.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 40.4 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 7.3 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.687 HG21 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 1.034 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.486 ' O ' HD12 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.709 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 1.034 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.994 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.994 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' NZ ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.918 HG21 ' HD1' ' A' ' 51' ' ' TYR . 60.6 m 80.06 125.34 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.4 47.2 0.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.5 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -147.25 -66.2 0.27 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.918 ' HD1' HG21 ' A' ' 48' ' ' THR . 81.1 m-85 -61.78 140.98 58.18 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.1 m -86.21 48.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.221 0.534 . . . . 0.0 111.052 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.93 -22.31 65.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.963 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -72.22 -32.36 66.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.059 0.457 . . . . 0.0 110.541 176.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 64.6 tt0 -77.73 124.04 86.47 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.98 -175.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 66.3 Cg_endo -92.53 135.74 1.42 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 123.141 2.561 . . . . 0.0 112.624 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -93.6 47.81 2.32 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.503 ' O ' ' HB2' ' A' ' 59' ' ' GLN . 78.1 mtp -88.45 122.26 31.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -173.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 58' ' ' MET . 10.5 tt0 . . . . . 0 C--O 1.243 0.73 0 O-C-N 124.579 1.175 . . . . 0.0 108.63 169.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.478 0.582 0 N-CA-C 110.182 -0.738 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.2 m120 58.53 -151.69 0.42 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.579 0.55 . . . . 0.0 110.031 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? 76.21 -38.12 0.32 Allowed 'General case' 0 N--CA 1.471 0.6 0 O-C-N 123.669 0.605 . . . . 0.0 111.17 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -65.43 128.34 35.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.347 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt -93.84 149.8 4.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.472 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.494 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.771 HD11 HG13 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.666 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.543 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.574 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.62 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.62 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m 29.64 85.6 0.01 OUTLIER 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.91 91.26 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.212 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -92.57 -81.9 0.34 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -97.16 11.9 34.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.924 0.393 . . . . 0.0 111.756 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -98.44 10.84 6.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.927 0.394 . . . . 0.0 110.684 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.41 -177.16 0.14 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.703 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -141.17 30.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.941 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 41.2 mt-30 -93.37 131.35 32.91 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.912 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 13.8 Cg_exo -70.3 97.27 0.67 Allowed 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.923 2.416 . . . . 0.0 112.198 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -91.84 -174.38 42.67 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.811 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 51.2 ttm -65.99 122.64 17.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.981 0.42 . . . . 0.0 110.415 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.054 -179.03 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo . . . . . 0 N--CA 1.482 0.814 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -61.9 -47.94 82.7 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.559 0.219 . . . . 0.0 110.865 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -142.44 -47.38 0.34 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.555 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.5 m -150.64 157.39 42.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.5 0.191 . . . . 0.0 110.899 -176.227 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt -91.25 126.94 43.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 170.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.648 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.562 HD11 HG13 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.459 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.711 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.711 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 85.8 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.562 HG13 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.681 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 50.3 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 HD11 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 61.7 m 72.09 -67.17 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -178.32 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.143 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.987 ' HE3' ' HA ' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -120.48 -53.63 2.1 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.311 -178.383 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -88.51 -33.61 17.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.291 0.567 . . . . 0.0 109.765 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.18 94.25 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.781 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -127.94 -63.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.064 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -159.75 -58.43 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.533 -176.469 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 55.6 tp60 -92.52 123.25 62.55 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -173.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 14.7 Cg_endo -90.64 151.01 4.21 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.233 2.622 . . . . 0.0 111.611 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.11 83.33 1.19 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.326 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.426 ' O ' ' HB3' ' A' ' 59' ' ' GLN . 28.1 ttt -65.54 141.43 58.46 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 58' ' ' MET . 56.1 tt0 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.235 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.919 -0.454 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -112.39 -40.13 4.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.804 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -85.8 101.97 13.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.703 -174.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.0 m 61.44 65.87 0.92 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.68 137.93 23.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.76 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.637 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.743 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.952 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.051 ' HB2' HD11 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.952 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.982 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.848 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 43.1 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 17.8 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.982 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 1.051 HD11 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.82 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.449 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.637 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 62.3 tp60 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.82 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p -78.42 46.79 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.748 ' HB1' ' HB ' ' A' ' 52' ' ' VAL . . . -77.09 -46.03 24.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.425 -167.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' NZ ' ' A' ' 50' ' ' LYS . 4.3 ttmp? 67.48 88.35 0.11 Allowed 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.41 0.444 . . . . 0.0 110.664 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.425 ' HD2' ' HG2' ' A' ' 50' ' ' LYS . 97.3 m-85 66.05 57.0 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.213 178.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.748 ' HB ' ' HB1' ' A' ' 49' ' ' ALA . 9.8 p -97.05 -16.17 7.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.1 82.0 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.824 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -68.6 -32.69 72.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.379 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -85.96 133.28 41.57 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.572 178.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.65 -1.09 10.78 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.654 2.236 . . . . 0.0 111.543 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.17 -100.06 2.04 Favored Glycine 0 N--CA 1.447 -0.624 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.807 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -85.7 135.92 33.57 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 63.8 tt0 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.553 177.615 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 110.736 -0.524 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -109.26 99.58 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.616 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 67.42 -68.95 0.14 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.958 0.903 . . . . 0.0 111.47 -178.103 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.6 t -82.85 111.47 18.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.513 HG21 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt -70.95 121.77 21.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.727 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.479 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.744 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.615 HG22 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.918 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.918 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.652 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.615 ' HB3' HG22 ' A' ' 16' ' ' THR . 22.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.53 HG22 ' CB ' ' A' ' 16' ' ' THR . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.967 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.741 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 7.3 t30 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.967 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.604 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.466 HD13 ' O ' ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.78 ' HB2' HD12 ' A' ' 33' ' ' LEU . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.509 HD11 ' HE3' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 47' ' ' ARG . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m -76.42 160.91 29.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.29 37.21 11.19 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.032 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -63.02 -17.89 62.72 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.263 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -66.72 -27.27 67.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.372 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.45 -40.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.73 -91.35 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 122.872 0.469 . . . . 0.0 110.18 -172.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -131.93 -18.18 2.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.134 0.492 . . . . 0.0 110.54 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -112.78 121.68 37.96 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.154 -175.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.06 140.46 95.32 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.65 2.233 . . . . 0.0 111.449 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -115.5 45.94 1.23 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.72 -175.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 94.1 mmm -80.39 121.77 26.12 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.553 -0.737 . . . . 0.0 109.358 177.464 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.027 -0.413 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 3' ' ' ARG . 7.3 t-20 60.24 -152.02 0.4 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.431 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 39.0 ttm180 71.67 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 122.887 0.475 . . . . 0.0 110.315 -177.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 p -88.53 126.49 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt -62.22 131.88 27.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.726 HD12 HG22 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 13' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 1.022 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 1.039 ' HB3' ' HB2' ' A' ' 22' ' ' SER 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . 1.039 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.807 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 1.021 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.671 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.789 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 50.5 mm-40 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.671 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.726 HG22 HD12 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.736 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.446 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.736 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.498 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.454 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 54.0 tp60 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.454 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m 53.51 83.24 0.07 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 62.59 10.03 3.85 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.965 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -133.93 61.21 1.68 Allowed 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -87.02 69.65 10.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.344 -0.844 . . . . 0.0 108.8 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 t 59.21 39.07 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 122.467 1.127 . . . . 0.0 108.533 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -139.48 167.07 22.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.885 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -132.84 109.5 9.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.242 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.478 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 4.7 tt0 -91.62 122.97 64.89 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.236 173.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 7.7 Cg_exo -73.99 46.4 1.31 Allowed 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.149 2.566 . . . . 0.0 112.527 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -163.44 175.77 39.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -85.32 139.37 31.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.67 0.235 . . . . 0.0 110.966 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 . . . . . 0 C--O 1.251 1.135 0 O-C-N 124.069 0.856 . . . . 0.0 111.653 177.65 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.476 0.458 0 N-CA-C 110.353 -0.672 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -122.92 -64.88 1.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.224 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 32.6 mmt180 62.51 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 O-C-N 124.101 0.876 . . . . 0.0 112.696 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.8 p -73.78 106.12 5.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.156 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.07 125.19 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 6' ' ' SER . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.499 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.831 HD11 HG13 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.462 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.58 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 4.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 45.4 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLN . . . . . 0.661 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 7.9 tp-100 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.831 HG13 HD11 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.635 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' MET . . . . . 0.841 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.46 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m 55.63 39.1 30.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.41 62.32 6.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.782 -176.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -103.2 113.87 27.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.6 4.3 19.01 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.5 t 67.22 102.21 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.609 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.39 149.65 22.19 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.558 174.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -74.96 62.86 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.059 0.456 . . . . 0.0 111.043 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.479 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 49.2 tt0 -110.63 120.94 42.55 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.86 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 10.7 Cg_exo -71.84 68.75 3.03 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 122.929 2.419 . . . . 0.0 112.149 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.47 146.88 18.36 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.817 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 83.4 mtp -87.66 123.57 32.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.9 0.381 . . . . 0.0 110.458 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.648 -0.691 . . . . 0.0 109.59 -179.325 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.446 HD12 HD11 ' A' ' 10' ' ' LEU . 20.9 pt . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.603 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.628 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.61 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.553 ' HA ' ' ND2' ' A' ' 36' ' ' ASN . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.474 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.497 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m . . . . . 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt . . . . . 0 CA--C 1.534 0.33 0 CA-C-O 120.662 0.268 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.531 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.568 HG13 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m . . . . . 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.436 HD12 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp . . . . . 0 N--CA 1.455 -0.21 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.492 ' O ' HG22 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.479 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.489 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 4.0 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.532 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.868 HE21 ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.488 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.763 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.601 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.963 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 38' ' ' GLN . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.963 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.452 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m . . . . . 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.486 HD12 ' O ' ' A' ' 35' ' ' SER . 30.2 mm . . . . . 0 N--CA 1.456 -0.169 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.49 ' HA ' HE21 ' A' ' 11' ' ' GLN . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 14' ' ' LEU . 28.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.426 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.687 ' HB2' HG21 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.546 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.558 HD23 HG21 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.489 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.546 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 38.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 6.9 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 3.1 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.687 HG21 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 1.034 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.486 ' O ' HD12 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.709 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 1.034 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.512 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.994 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.994 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.44 ' NZ ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.453 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 60.6 m . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt . . . . . 0 C--O 1.236 0.39 0 CA-C-O 120.998 0.427 . . . . 0.0 111.472 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.494 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.771 HD11 HG13 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.666 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.543 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.574 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.62 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.62 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m . . . . . 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt . . . . . 0 N--CA 1.454 -0.244 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.648 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.562 HD11 HG13 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.459 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.711 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.711 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 26.4 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.562 HG13 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.681 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 HD11 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 61.7 m . . . . . 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp . . . . . 0 C--O 1.235 0.322 0 CA-C-O 120.817 0.341 . . . . 0.0 110.76 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.637 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.743 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.952 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 1.051 ' HB2' HD11 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.952 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.982 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.848 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 6.3 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 2.2 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.982 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 1.051 HD11 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.82 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.449 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.637 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.82 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p . . . . . 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.513 HG21 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt . . . . . 0 N--CA 1.454 -0.272 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.727 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.479 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.744 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.615 HG22 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.918 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.918 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HA ' HE21 ' A' ' 28' ' ' GLN . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.652 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.615 ' HB3' HG22 ' A' ' 16' ' ' THR . 2.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.53 HG22 ' CB ' ' A' ' 16' ' ' THR . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.967 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.741 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 27.6 t-20 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.967 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.604 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.466 HD13 ' O ' ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.78 ' HB2' HD12 ' A' ' 33' ' ' LEU . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.509 HD11 ' HE3' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 47' ' ' ARG . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m . . . . . 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt . . . . . 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.726 HD12 HG22 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 13' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 1.022 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 1.039 ' HB3' ' HB2' ' A' ' 22' ' ' SER 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 1.039 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.807 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 1.021 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.671 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.789 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 8.1 mm100 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.671 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.726 HG22 HD12 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.736 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.446 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.736 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.498 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.454 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 6.9 tp-100 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.454 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m . . . . . 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt . . . . . 0 C--O 1.234 0.288 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 6' ' ' SER . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.499 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.831 HD11 HG13 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.462 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.58 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 26.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLN . . . . . 0.661 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 58.7 tp60 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.831 HG13 HD11 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.635 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' MET . . . . . 0.841 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.46 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_endo . . . . . 0 N--CA 1.476 0.475 0 N-CA-C 110.442 -0.638 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.0 p-10 -96.44 -11.77 25.16 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.348 0.594 . . . . 0.0 109.925 176.149 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 3' ' ' ARG . 24.6 mtp85 -137.27 72.45 1.42 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.294 176.482 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.0 t -92.37 54.01 2.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.558 0.694 . . . . 0.0 110.132 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.446 HD12 HD11 ' A' ' 10' ' ' LEU . 20.9 pt -105.04 149.55 8.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.568 177.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.439 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 35.1 t -81.35 116.27 61.79 Favored Pre-proline 0 C--N 1.324 -0.537 0 CA-C-O 120.928 0.394 . . . . 0.0 110.829 -178.283 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 16.7 Cg_exo -69.12 -30.73 24.74 Favored 'Trans proline' 0 N--CA 1.462 -0.358 0 C-N-CA 122.923 2.415 . . . . 0.0 111.428 177.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.4 t -60.29 -38.96 85.24 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.147 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.97 -43.82 74.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.468 178.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.626 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.8 mt -61.98 -48.09 81.9 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.15 -179.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -62.79 -37.78 88.08 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.161 -179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.423 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 20.7 t70 -69.44 -35.68 75.9 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 178.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 59.2 tp -61.26 -41.07 96.29 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.899 177.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 16.1 mt -57.23 -45.85 83.52 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.222 0.534 . . . . 0.0 109.974 178.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 51.8 mtp180 -54.47 -49.41 70.16 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.927 177.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 1.8 m -70.82 -38.61 73.29 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.316 -1.311 . . . . 0.0 111.976 -172.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 58.7 mt -67.61 -33.7 75.51 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.603 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 13.2 mmmm -77.75 -27.92 50.56 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -173.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.5 p -102.16 99.07 11.55 Favored Pre-proline 0 C--N 1.324 -0.53 0 C-N-CA 120.828 -0.349 . . . . 0.0 110.798 177.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.628 ' HA ' ' HG3' ' A' ' 25' ' ' GLN . 84.1 Cg_endo -100.54 -4.85 0.48 Allowed 'Trans proline' 0 N--CA 1.452 -0.946 0 C-N-CA 123.268 2.645 . . . . 0.0 113.207 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 t -84.49 58.28 4.78 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.26 -0.644 . . . . 0.0 109.26 -178.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.418 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 66.8 p -171.01 149.15 2.65 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.534 -178.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 38.1 Cg_exo -62.22 -21.1 72.01 Favored 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 123.226 2.617 . . . . 0.0 111.859 174.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 24.2 mp0 -69.65 -25.16 63.78 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.833 -175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.628 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 24.0 tm0? -56.4 -56.26 23.4 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.044 0.215 . . . . 0.0 111.566 -173.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -62.8 -47.44 83.47 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 111.923 0.342 . . . . 0.0 111.923 -178.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -67.41 -52.15 43.24 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.929 -175.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.61 ' O ' HG13 ' A' ' 32' ' ' ILE . 15.5 mm100 -68.59 -46.88 68.2 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.722 -173.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 79.0 t -58.79 -44.95 91.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 120.994 -0.282 . . . . 0.0 111.128 -176.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 tt -62.7 -40.53 97.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.674 0.273 . . . . 0.0 110.406 -178.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -67.78 -39.82 84.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.836 0.35 . . . . 0.0 110.433 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.61 HG13 ' O ' ' A' ' 28' ' ' GLN . 59.5 mt -66.22 -40.14 86.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 120.983 0.42 . . . . 0.0 110.142 176.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.553 ' HA ' ' ND2' ' A' ' 36' ' ' ASN . 40.3 mt -56.98 -33.66 67.31 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.85 176.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 50.1 tptt -70.07 -28.04 65.12 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.535 177.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.0 t -76.57 -29.03 56.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.117 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.553 ' ND2' ' HA ' ' A' ' 33' ' ' LEU . 0.4 OUTLIER -122.01 72.91 35.17 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.496 0.665 . . . . 0.0 109.622 172.798 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -56.43 -28.19 71.83 Favored 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 123.838 3.025 . . . . 0.0 113.902 -166.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -61.15 -37.18 81.96 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.804 0.335 . . . . 0.0 110.771 -177.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -76.67 -35.03 58.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.772 178.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.474 ' HB2' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttt -62.98 -42.21 99.78 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 177.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.41 -41.34 80.17 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.908 177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.92 -45.62 81.27 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.068 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -62.89 -44.94 94.74 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.289 179.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.497 ' O ' ' HD2' ' A' ' 47' ' ' ARG . 72.1 mt -65.37 -36.56 77.98 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.746 0.308 . . . . 0.0 110.567 -179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -63.29 -29.46 70.78 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.854 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -83.15 -15.42 50.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.314 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.497 ' HD2' ' O ' ' A' ' 44' ' ' ILE . 18.7 mmm180 60.3 28.55 18.17 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.057 178.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.2 m 66.44 -82.68 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 122.849 0.46 . . . . 0.0 112.154 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -130.44 14.36 5.52 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.085 0.469 . . . . 0.0 111.703 -175.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 mmtm -93.66 139.64 30.56 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 175.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 76.0 m-85 -97.97 87.7 4.05 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.431 0.634 . . . . 0.0 110.588 -174.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 29.9 m -102.31 9.81 8.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.566 0 CA-C-N 115.147 -0.933 . . . . 0.0 110.637 -178.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.16 56.99 3.0 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.448 0.642 . . . . 0.0 110.511 178.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.4 t-20 -120.12 100.54 7.25 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.701 -179.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -110.52 136.4 20.62 Favored Pre-proline 0 C--N 1.32 -0.701 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -70.23 48.3 0.7 Allowed 'Trans proline' 0 C--N 1.348 0.516 0 C-N-CA 123.106 2.537 . . . . 0.0 113.072 -178.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -130.14 2.31 5.86 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.325 -0.71 . . . . 0.0 111.325 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 25.8 mmt -87.91 139.34 30.61 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 -179.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 . . . . . 0 C--O 1.251 1.132 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.079 178.604 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.474 0.348 0 N-CA-C 110.397 -0.655 . . . . 0.0 110.397 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -65.03 -34.98 79.74 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' A' ' 3' ' ' ARG . 64.9 mtt180 70.02 13.71 7.85 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.397 179.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.8 t -121.58 -40.88 2.52 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.867 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.2 tt -69.57 139.45 20.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.698 -177.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.463 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 11.7 m -65.97 117.45 42.51 Favored Pre-proline 0 C--O 1.234 0.261 0 CA-C-O 121.073 0.463 . . . . 0.0 111.333 -175.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 24.8 Cg_exo -64.33 -43.47 14.24 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.556 2.837 . . . . 0.0 112.852 -175.632 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 29.8 t -59.2 -40.82 86.96 Favored 'General case' 0 CA--C 1.528 0.133 0 CA-C-N 116.709 -0.223 . . . . 0.0 111.129 -177.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.22 -45.43 91.12 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.061 0.458 . . . . 0.0 110.403 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.714 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 92.1 mt -67.07 -47.58 70.83 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.02 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 31.3 mm-40 -58.89 -48.11 82.57 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.407 -0.361 . . . . 0.0 111.477 -177.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.535 ' O ' HG22 ' A' ' 16' ' ' THR . 0.5 OUTLIER -69.28 -32.57 71.82 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.276 -177.068 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.568 HD11 HG13 ' A' ' 29' ' ' VAL . 59.1 tp -59.51 -45.84 90.56 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.304 176.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.714 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -59.94 -46.03 90.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.384 0.611 . . . . 0.0 109.928 177.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 11' ' ' GLN . 40.5 mmt180 -56.91 -51.08 70.55 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.933 -177.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.535 HG22 ' O ' ' A' ' 12' ' ' ASP . 4.9 t -74.35 -39.32 62.87 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.344 0.498 . . . . 0.0 112.344 -177.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.9 -35.2 79.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.809 0.338 . . . . 0.0 111.653 -173.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.531 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 38.2 mtpt -86.39 6.08 31.83 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.811 0.338 . . . . 0.0 111.449 -176.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 14.1 t -102.23 98.62 10.77 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 173.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.531 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 10.5 Cg_endo -93.74 171.93 1.84 Allowed 'Trans proline' 0 N--CA 1.456 -0.707 0 C-N-CA 123.651 2.901 . . . . 0.0 112.147 179.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.4 t 55.96 36.61 27.65 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-O 122.006 0.908 . . . . 0.0 109.015 -173.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.424 ' HA ' ' HD3' ' A' ' 23' ' ' PRO . 68.5 m -152.82 138.46 11.67 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 114.793 -1.094 . . . . 0.0 109.55 -174.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 22' ' ' SER . 51.3 Cg_exo -55.48 -22.64 35.48 Favored 'Trans proline' 0 C--N 1.344 0.314 0 C-N-CA 123.427 2.752 . . . . 0.0 113.17 -178.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.43 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 76.3 mt-30 -62.37 -38.38 89.35 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.211 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -56.38 -52.0 66.23 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.71 -175.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 mp0 -76.98 -50.27 13.55 Favored 'General case' 0 C--N 1.32 -0.674 0 CA-C-O 120.804 0.335 . . . . 0.0 111.671 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.9 tp-100 -70.52 -55.46 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -170.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -72.72 -43.97 62.3 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.648 -170.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.568 HG13 HD11 ' A' ' 13' ' ' LEU . 87.6 t -59.57 -38.83 77.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.805 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 50.8 tp -62.83 -41.2 99.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.453 178.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -67.45 -44.36 78.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.161 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 69.8 mt -64.88 -41.75 93.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.711 -179.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.671 ' HB3' ' SD ' ' A' ' 40' ' ' MET . 25.6 mt -60.16 -34.86 74.16 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.988 176.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -62.69 -30.96 71.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.145 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 p -90.67 1.13 57.09 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.982 0.42 . . . . 0.0 111.315 179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -128.2 78.86 74.89 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.048 0.451 . . . . 0.0 109.827 177.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 16.2 Cg_endo -57.2 -28.18 78.15 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 123.476 2.784 . . . . 0.0 113.628 -171.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -62.0 -54.14 45.78 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.789 0.328 . . . . 0.0 111.25 -179.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.416 HD22 ' HA ' ' A' ' 39' ' ' LEU . 0.3 OUTLIER -74.51 -38.3 62.86 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 109.738 -0.468 . . . . 0.0 109.738 -176.583 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.671 ' SD ' ' HB3' ' A' ' 33' ' ' LEU . 4.4 tpt -61.1 -45.07 96.21 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.802 -179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -58.7 -44.15 90.26 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.872 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -65.4 -39.54 92.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.89 179.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 51.2 t80 -66.56 -42.87 86.43 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.955 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.523 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 77.0 mt -69.37 -36.48 72.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-O 120.984 0.421 . . . . 0.0 110.47 178.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -59.81 -49.13 78.9 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.172 0.51 . . . . 0.0 110.384 176.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.582 ' HA ' ' HB ' ' A' ' 52' ' ' VAL . 33.5 tt0 -75.82 -24.21 55.84 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.894 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.523 ' HG3' ' O ' ' A' ' 44' ' ' ILE . 57.1 mtm180 57.3 54.54 6.6 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.592 -179.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.4 m 70.2 -67.71 0.23 Allowed 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.172 -178.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -172.18 36.47 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.352 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 43.5 mtpt -104.12 97.44 7.4 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.532 -176.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 43.5 t80 75.0 -35.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 123.904 0.881 . . . . 0.0 112.277 173.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.582 ' HB ' ' HA ' ' A' ' 46' ' ' GLN . 12.0 t -86.75 57.46 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 CA-C-O 121.646 0.736 . . . . 0.0 110.728 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -83.91 142.85 30.26 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.12 58.41 1.55 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.108 0.48 . . . . 0.0 110.995 -168.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 0.6 OUTLIER -97.27 118.64 64.34 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 170.807 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 6.3 Cg_endo -86.84 5.99 5.55 Favored 'Trans proline' 0 N--CA 1.458 -0.591 0 C-N-CA 123.167 2.578 . . . . 0.0 112.156 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 130.24 -52.14 0.84 Allowed Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 -175.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 57.0 ttp -78.67 134.96 37.08 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 173.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.646 -0.692 . . . . 0.0 110.086 -179.931 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo . . . . . 0 N--CA 1.48 0.68 0 CA-C-O 120.445 0.102 . . . . 0.0 112.325 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 m120 -82.79 -12.48 57.46 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 -171.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.438 HH11 ' HD2' ' A' ' 3' ' ' ARG . 46.5 ttm180 -112.89 125.96 54.94 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 122.316 -0.24 . . . . 0.0 111.254 -176.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.5 t 75.02 155.43 0.17 Allowed 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.803 0.811 . . . . 0.0 112.323 173.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.436 HD12 ' OD1' ' A' ' 36' ' ' ASN . 5.2 tp -93.76 131.68 40.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 114.926 -1.033 . . . . 0.0 109.148 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 23.3 t -69.23 117.11 49.0 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.706 0.289 . . . . 0.0 110.657 -177.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -71.68 -23.6 22.69 Favored 'Trans proline' 0 C--N 1.345 0.373 0 C-N-CA 122.567 2.178 . . . . 0.0 111.972 179.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.3 m -63.9 -45.86 87.45 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.417 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.22 -35.84 81.65 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.911 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.7 mt -65.34 -39.99 93.08 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.757 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.599 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 80.2 mt-30 -70.18 -44.02 69.59 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.831 178.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.492 ' O ' HG22 ' A' ' 16' ' ' THR . 71.2 m-20 -60.52 -40.93 93.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 177.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 60.7 tp -59.97 -47.65 84.96 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.391 -179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.599 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 2.2 pp -63.39 -36.14 82.74 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.032 0.444 . . . . 0.0 110.368 -177.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 34.8 mmt180 -64.92 -51.47 61.69 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.388 -0.824 . . . . 0.0 111.576 179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' O ' ' A' ' 12' ' ' ASP . 6.4 t -73.43 -38.56 65.5 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -175.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.4 tt -69.12 -34.94 75.84 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.548 -173.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.465 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 98.6 mttt -77.27 -21.59 53.42 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 111.755 0.28 . . . . 0.0 111.755 -176.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.9 m -102.01 100.64 15.52 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.807 0.337 . . . . 0.0 110.906 178.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 71.6 Cg_endo -90.14 8.65 3.5 Favored 'Trans proline' 0 N--CA 1.461 -0.389 0 C-N-CA 122.956 2.437 . . . . 0.0 112.943 -177.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 20.0 m -92.71 29.97 1.66 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.567 -175.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.2 t -167.19 149.21 5.49 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 109.653 -0.499 . . . . 0.0 109.653 -176.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -48.37 -19.8 2.07 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 124.383 3.389 . . . . 0.0 113.708 176.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.479 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 50.6 mt-30 -59.6 -31.9 69.91 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.728 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.452 ' HG3' ' HA ' ' A' ' 20' ' ' PRO . 0.7 OUTLIER -57.33 -55.55 33.35 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.165 -0.309 . . . . 0.0 110.165 -176.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.489 ' HG3' ' HG2' ' A' ' 27' ' ' GLN . 4.0 pt20 -76.44 -50.87 13.0 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.566 -0.454 . . . . 0.0 111.723 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.532 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 9.6 mm-40 -70.92 -52.08 22.16 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.868 HE21 ' HA ' ' A' ' 28' ' ' GLN . 0.0 OUTLIER -67.68 -44.77 76.99 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.83 -0.168 . . . . 0.0 111.093 -173.131 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.488 ' O ' HD23 ' A' ' 33' ' ' LEU . 92.9 t -59.38 -44.93 93.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.689 0.281 . . . . 0.0 110.314 177.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 51.5 tp -55.43 -46.33 76.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.217 0.532 . . . . 0.0 110.514 177.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 26.7 t-20 -68.43 -43.91 76.13 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.38 -178.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.68 HG22 ' HG2' ' A' ' 37' ' ' PRO . 79.3 mt -62.93 -50.06 81.11 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.325 0 C-N-CA 121.145 -0.222 . . . . 0.0 110.699 -176.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 4.6 mm? -56.29 -30.82 63.01 Favored 'General case' 0 C--O 1.211 -0.927 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.951 -177.146 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -70.82 -27.07 63.61 Favored 'General case' 0 C--N 1.317 -0.823 0 O-C-N 121.603 -0.686 . . . . 0.0 112.62 -177.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 88.9 p -80.41 -27.23 38.1 Favored 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 113.904 1.076 . . . . 0.0 113.904 -167.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.763 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 2.7 t-20 -169.28 -44.89 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.962 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -169.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 78.7 Cg_exo -47.59 0.88 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.615 1 C-N-CA 125.617 4.211 . . . . 0.0 114.58 156.674 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.601 ' H ' ' C ' ' A' ' 36' ' ' ASN . 14.0 pt20 -44.29 -12.14 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 126.362 1.865 . . . . 0.0 113.719 -170.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.409 ' O ' HD13 ' A' ' 39' ' ' LEU . 2.8 tm? -48.33 -34.99 11.52 Favored 'General case' 0 CA--C 1.55 0.955 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 165.141 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.963 ' HG3' ' HD2' ' A' ' 43' ' ' PHE . 37.1 ttp -72.0 -30.14 64.92 Favored 'General case' 0 N--CA 1.47 0.55 0 O-C-N 121.842 -0.536 . . . . 0.0 110.791 173.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 38' ' ' GLN . . . -54.78 -38.56 67.42 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 119.748 -0.781 . . . . 0.0 109.672 176.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.87 -43.74 67.79 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.691 171.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.963 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 8.4 t80 -50.32 -44.18 54.13 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.606 178.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.452 HD11 ' HE3' ' A' ' 40' ' ' MET . 70.8 mt -61.56 -40.39 86.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-O 120.82 0.343 . . . . 0.0 111.048 179.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -71.52 -29.24 64.56 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.167 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -83.05 -42.05 17.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.979 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' O ' ' HB ' ' A' ' 48' ' ' THR . 52.4 mtp180 64.37 18.42 11.31 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.464 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.415 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 90.5 m 70.06 117.85 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.276 0 O-C-N 123.744 0.652 . . . . 0.0 110.743 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -68.3 82.11 0.24 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.571 -0.74 . . . . 0.0 112.102 -175.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -93.72 -29.06 15.59 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.816 177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.41 ' HD1' HG23 ' A' ' 52' ' ' VAL . 11.5 p90 -144.61 161.66 38.59 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.176 -176.537 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG23 ' HD1' ' A' ' 51' ' ' TYR . 54.6 t 66.6 -79.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 115.175 -0.92 . . . . 0.0 111.858 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.51 58.69 4.05 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.074 0.464 . . . . 0.0 110.433 -178.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -64.23 -33.14 75.13 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.69 -178.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 3.9 pt20 -83.54 123.83 76.13 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.162 -0.472 . . . . 0.0 109.966 174.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 3.4 Cg_exo -77.67 7.13 4.02 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 123.249 2.632 . . . . 0.0 113.367 -174.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 166.11 -162.25 35.81 Favored Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 120.513 -0.851 . . . . 0.0 112.226 179.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.855 ' HG3' ' HG2' ' A' ' 59' ' ' GLN . 54.7 tpp -81.1 138.0 35.95 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 110.13 -0.322 . . . . 0.0 110.13 179.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.855 ' HG2' ' HG3' ' A' ' 58' ' ' MET . 15.9 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.401 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_exo . . . . . 0 N--CA 1.479 0.63 0 N-CA-C 110.79 -0.504 . . . . 0.0 110.79 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 26.3 p-10 -166.05 163.02 18.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 46.4 ttp180 -92.33 49.84 1.55 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.823 0.821 . . . . 0.0 109.732 -178.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.0 m -153.14 125.8 8.26 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.08 -0.964 . . . . 0.0 108.508 178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.486 HD12 ' O ' ' A' ' 35' ' ' SER . 30.2 mm -69.19 114.61 6.38 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 CA-C-O 121.024 0.44 . . . . 0.0 111.001 -173.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.461 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 8.3 m -68.38 129.83 92.57 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.735 179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 21.5 Cg_exo -66.18 -7.79 18.33 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 123.324 2.683 . . . . 0.0 112.531 178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.49 ' HA ' HE21 ' A' ' 11' ' ' GLN . 1.5 m -57.1 -43.7 82.5 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.273 178.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.672 ' HB1' HG23 ' A' ' 32' ' ' ILE . . . -63.13 -35.33 79.93 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.626 -177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.8 mt -67.28 -47.23 71.28 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.123 0.487 . . . . 0.0 110.801 -176.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.515 ' HA ' HD23 ' A' ' 14' ' ' LEU . 28.7 pt20 -71.74 -34.98 69.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.577 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.426 ' O ' HG22 ' A' ' 16' ' ' THR . 9.5 t70 -67.33 -38.01 84.2 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.513 179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.687 ' HB2' HG21 ' A' ' 32' ' ' ILE . 64.1 tp -59.63 -47.81 84.13 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 115.726 -0.67 . . . . 0.0 111.591 -177.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.515 HD23 ' HA ' ' A' ' 11' ' ' GLN . 2.0 pp -61.81 -35.47 78.31 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.42 0.629 . . . . 0.0 110.177 -178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.425 ' HG3' ' O ' ' A' ' 11' ' ' GLN . 97.9 mtt180 -66.98 -52.15 46.25 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.633 -179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.546 ' HG1' ' HB3' ' A' ' 24' ' ' GLN . 7.6 t -74.43 -43.52 55.85 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.555 0.576 . . . . 0.0 112.555 -175.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.558 HD23 HG21 ' A' ' 29' ' ' VAL . 3.1 tm? -64.0 -22.76 67.06 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 121.218 0.532 . . . . 0.0 110.531 -175.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.489 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 23.3 ttmm -71.5 -16.46 62.35 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.867 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 45.9 t -102.13 101.27 18.14 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 120.873 0.368 . . . . 0.0 110.806 179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.489 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 85.3 Cg_endo -90.25 -6.01 4.7 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 122.445 2.096 . . . . 0.0 112.311 177.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -79.61 -32.26 41.8 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.493 0.663 . . . . 0.0 110.561 -179.083 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.515 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 77.3 p -97.08 163.49 19.86 Favored Pre-proline 0 C--N 1.321 -0.631 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.414 -172.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.515 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 20.8 Cg_endo -60.08 -18.7 52.44 Favored 'Trans proline' 0 C--N 1.348 0.547 0 C-N-CA 123.806 3.004 . . . . 0.0 112.181 175.128 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.546 ' HB3' ' HG1' ' A' ' 16' ' ' THR . 38.0 mt-30 -60.61 -25.63 66.4 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.952 -172.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.448 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 6.9 tt0 -55.67 -57.22 12.87 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.075 -178.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 27' ' ' GLN . 3.1 pt20 -79.6 -51.36 9.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.306 -0.558 . . . . 0.0 112.095 176.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.567 ' HG3' ' HG3' ' A' ' 26' ' ' GLN . 85.8 mt-30 -70.31 -54.23 13.48 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -167.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -72.02 -41.73 67.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.816 0.341 . . . . 0.0 110.981 -175.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.58 HG12 ' CD2' ' A' ' 33' ' ' LEU . 56.0 t -59.34 -39.86 80.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.459 175.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 29.1 tp -58.1 -36.45 72.9 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.827 0.346 . . . . 0.0 110.765 179.132 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -65.12 -39.02 92.51 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.431 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.687 HG21 ' HB2' ' A' ' 13' ' ' LEU . 88.7 mt -73.9 -30.37 28.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.971 178.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 1.034 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 0.4 OUTLIER -52.75 -32.12 41.69 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.2 176.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -68.52 -26.87 65.66 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 -179.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.486 ' O ' HD12 ' A' ' 5' ' ' ILE . 23.9 m -80.46 -24.57 39.44 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -167.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.709 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 65.5 t30 -175.14 -43.34 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.95 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 -172.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 1.034 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 43.2 Cg_exo -45.82 -2.28 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 125.173 3.915 . . . . 0.0 115.142 161.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.512 ' H ' ' C ' ' A' ' 36' ' ' ASN . 43.7 mt-30 -44.47 -12.34 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.717 1.607 . . . . 0.0 113.198 -176.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -46.81 -29.27 1.88 Allowed 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 120.764 -0.374 . . . . 0.0 110.021 164.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.994 ' HA ' ' HB3' ' A' ' 43' ' ' PHE . 3.5 ppp? -52.97 -30.05 32.61 Favored 'General case' 0 CA--C 1.506 -0.727 0 C-N-CA 122.985 0.514 . . . . 0.0 110.789 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.18 -44.08 74.92 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.761 174.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -74.37 -45.55 46.22 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 121.228 0.537 . . . . 0.0 110.48 171.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.994 ' HB3' ' HA ' ' A' ' 40' ' ' MET . 2.2 t80 -52.74 -49.89 64.55 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 115.228 -0.896 . . . . 0.0 112.405 -177.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 77.7 mt -71.7 -34.33 51.74 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.861 0 CA-C-O 120.972 0.415 . . . . 0.0 110.522 -177.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.44 ' NZ ' ' HB2' ' A' ' 45' ' ' LYS . 0.1 OUTLIER -70.87 -49.12 49.43 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.009 179.39 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -83.99 -47.36 11.07 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 115.93 -0.577 . . . . 0.0 112.361 -173.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.453 ' O ' ' HB ' ' A' ' 48' ' ' THR . 15.0 tpp180 -97.73 -50.0 4.62 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.393 -177.298 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.918 HG21 ' HD1' ' A' ' 51' ' ' TYR . 60.6 m 80.06 125.34 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 O-C-N 123.862 0.726 . . . . 0.0 111.705 177.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.4 47.2 0.94 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.5 178.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -147.25 -66.2 0.27 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.712 -178.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.918 ' HD1' HG21 ' A' ' 48' ' ' THR . 81.1 m-85 -61.78 140.98 58.18 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 177.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 17.1 m -86.21 48.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-O 121.221 0.534 . . . . 0.0 111.052 -177.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -67.93 -22.31 65.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.963 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -72.22 -32.36 66.67 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.059 0.457 . . . . 0.0 110.541 176.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 64.6 tt0 -77.73 124.04 86.47 Favored Pre-proline 0 C--N 1.328 -0.36 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.98 -175.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 66.3 Cg_endo -92.53 135.74 1.42 Allowed 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 123.141 2.561 . . . . 0.0 112.624 179.145 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -93.6 47.81 2.32 Favored Glycine 0 N--CA 1.45 -0.408 0 N-CA-C 110.866 -0.894 . . . . 0.0 110.866 177.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.503 ' O ' ' HB2' ' A' ' 59' ' ' GLN . 78.1 mtp -88.45 122.26 31.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -173.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.503 ' HB2' ' O ' ' A' ' 58' ' ' MET . 10.5 tt0 . . . . . 0 C--O 1.243 0.73 0 O-C-N 124.579 1.175 . . . . 0.0 108.63 169.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.478 0.582 0 N-CA-C 110.182 -0.738 . . . . 0.0 110.182 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.2 m120 58.53 -151.69 0.42 Allowed 'General case' 0 N--CA 1.466 0.328 0 O-C-N 123.579 0.55 . . . . 0.0 110.031 -178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 2.6 tpm_? 76.21 -38.12 0.32 Allowed 'General case' 0 N--CA 1.471 0.6 0 O-C-N 123.669 0.605 . . . . 0.0 111.17 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 21.0 t -65.43 128.34 35.49 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.347 178.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 pt -93.84 149.8 4.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.472 -176.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 41.1 t -78.96 118.45 72.53 Favored Pre-proline 0 C--N 1.326 -0.425 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.775 178.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -69.87 -23.54 30.19 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.505 2.136 . . . . 0.0 111.847 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 t -65.89 -38.07 87.77 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.843 -0.429 . . . . 0.0 109.843 178.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.74 -38.87 92.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.249 176.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 96.3 mt -69.38 -42.08 75.64 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.726 178.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.494 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 48.3 mt-30 -63.79 -42.03 97.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.439 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.1 t70 -70.39 -30.5 67.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.379 0.609 . . . . 0.0 110.19 178.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.771 HD11 HG13 ' A' ' 29' ' ' VAL . 54.6 tp -67.19 -48.45 67.89 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.243 -0.89 . . . . 0.0 110.987 179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.666 ' O ' ' HG2' ' A' ' 18' ' ' LYS . 2.8 pp -67.9 -36.18 79.76 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 177.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.7 tpt180 -56.81 -48.31 78.27 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 114.429 -1.26 . . . . 0.0 111.596 179.727 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.418 HG22 ' O ' ' A' ' 13' ' ' LEU . 3.9 t -70.47 -36.89 74.14 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.921 0.391 . . . . 0.0 110.406 178.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 8.8 tt -66.08 -19.17 65.76 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.29 -178.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.666 ' HG2' ' O ' ' A' ' 14' ' ' LEU . 73.2 mmtt -70.26 -8.28 48.93 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.699 0.285 . . . . 0.0 110.751 178.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 30.9 t -101.38 99.68 11.81 Favored Pre-proline 0 N--CA 1.449 -0.512 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 171.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.43 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 5.7 Cg_exo -78.76 84.01 2.13 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.926 2.417 . . . . 0.0 111.929 -175.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.7 m -144.69 147.25 32.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.713 177.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.543 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 41.1 t -46.04 -58.46 6.32 Favored Pre-proline 0 CA--C 1.54 0.57 0 O-C-N 123.746 0.654 . . . . 0.0 112.542 -174.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo -60.84 -40.9 49.75 Favored 'Trans proline' 0 C--N 1.356 0.934 0 C-N-CA 122.097 1.864 . . . . 0.0 112.676 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -66.62 -36.27 82.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.901 0.381 . . . . 0.0 110.593 -177.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.574 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 22.0 tp60 -70.32 -57.11 5.21 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.356 -177.245 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.543 ' HG2' ' O ' ' A' ' 22' ' ' SER . 9.0 pt20 -78.77 -51.37 9.86 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -176.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.1 mm-40 -70.19 -54.36 13.18 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -171.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 10.9 mp0 -72.42 -49.49 33.27 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.343 0.498 . . . . 0.0 112.343 -174.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.771 HG13 HD11 ' A' ' 13' ' ' LEU . 71.7 t -61.05 -43.49 96.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 -176.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.11 -44.72 87.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.928 0.394 . . . . 0.0 110.125 -179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -64.0 -44.48 92.53 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.608 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 63.6 mt -72.59 -39.99 62.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-O 120.981 0.42 . . . . 0.0 110.549 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 39' ' ' LEU . 6.8 tp -65.01 -36.47 84.51 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.157 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.5 ' HA ' ' HG2' ' A' ' 40' ' ' MET . 36.7 tttm -63.24 -26.93 69.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.612 177.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -71.11 -11.9 61.2 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.236 178.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -117.68 78.93 12.33 Favored Pre-proline 0 C--N 1.325 -0.487 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 173.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -61.45 -25.26 79.59 Favored 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 123.122 2.548 . . . . 0.0 113.366 -169.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -70.57 -46.35 63.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.894 0.378 . . . . 0.0 110.45 -179.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD12 HD11 ' A' ' 33' ' ' LEU . 1.4 tm? -75.68 -43.05 49.31 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.737 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.655 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 4.6 tpt -60.24 -39.69 87.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.616 -0.72 . . . . 0.0 111.1 -177.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -59.68 -36.26 76.1 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.021 179.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.57 -41.27 79.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.903 -179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HE1' ' OG1' ' A' ' 48' ' ' THR . 8.3 t80 -66.55 -43.96 83.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.316 178.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 85.4 mt -62.41 -36.25 73.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-O 121.083 0.468 . . . . 0.0 110.283 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -68.84 -45.73 70.37 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.457 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.62 ' HG3' ' H ' ' A' ' 48' ' ' THR . 10.2 pt20 -69.47 -35.64 75.8 Favored 'General case' 0 C--N 1.331 -0.228 0 C-N-CA 120.596 -0.442 . . . . 0.0 110.724 -178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 6.4 tpm_? 66.11 10.37 7.01 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.592 172.246 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.62 ' H ' ' HG3' ' A' ' 46' ' ' GLN . 21.4 m 29.64 85.6 0.01 OUTLIER 'General case' 0 C--O 1.24 0.59 0 C-N-CA 123.796 0.838 . . . . 0.0 112.929 -177.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -69.91 91.26 0.65 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.212 -178.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -92.57 -81.9 0.34 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.918 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 44.0 p90 -97.16 11.9 34.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.924 0.393 . . . . 0.0 111.756 -175.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 27.5 m -98.44 10.84 6.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-O 120.927 0.394 . . . . 0.0 110.684 178.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.41 -177.16 0.14 Allowed 'General case' 0 C--O 1.231 0.116 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.703 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 25.4 p30 -141.17 30.06 1.8 Allowed 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.941 178.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.467 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 41.2 mt-30 -93.37 131.35 32.91 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.912 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 13.8 Cg_exo -70.3 97.27 0.67 Allowed 'Trans proline' 0 C--O 1.234 0.324 0 C-N-CA 122.923 2.416 . . . . 0.0 112.198 -179.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -91.84 -174.38 42.67 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.003 -0.618 . . . . 0.0 111.811 178.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 51.2 ttm -65.99 122.64 17.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.981 0.42 . . . . 0.0 110.415 -178.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 . . . . . 0 C--O 1.247 0.931 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.054 -179.03 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_exo . . . . . 0 N--CA 1.482 0.814 0 N-CA-C 110.208 -0.728 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -61.9 -47.94 82.7 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.559 0.219 . . . . 0.0 110.865 -179.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -142.44 -47.38 0.34 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 120.373 -0.531 . . . . 0.0 111.555 176.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 40.5 m -150.64 157.39 42.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.5 0.191 . . . . 0.0 110.899 -176.227 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 23.3 pt -91.25 126.94 43.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 170.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.44 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 30.0 p -65.3 126.5 91.52 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.223 -176.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 6' ' ' SER . 26.2 Cg_exo -62.53 -19.15 66.84 Favored 'Trans proline' 0 C--N 1.344 0.295 0 C-N-CA 122.917 2.411 . . . . 0.0 111.655 179.069 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.2 m -63.51 -40.46 97.12 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.466 178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.36 -36.55 74.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.289 0.566 . . . . 0.0 110.629 177.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.648 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 90.2 mt -69.73 -48.45 59.43 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.011 -178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -65.02 -36.8 85.56 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.886 -177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.509 ' O ' ' HG3' ' A' ' 15' ' ' ARG . 6.7 t70 -65.57 -32.1 73.5 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.946 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.562 HD11 HG13 ' A' ' 29' ' ' VAL . 54.2 tp -68.61 -46.6 68.86 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.425 176.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 13.6 mt -60.88 -47.67 85.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.407 -176.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.509 ' HG3' ' O ' ' A' ' 12' ' ' ASP . 3.4 ppt_? -56.64 -48.52 77.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.722 -0.672 . . . . 0.0 112.385 -174.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.459 ' N ' ' HD2' ' A' ' 15' ' ' ARG . 3.5 t -72.58 -37.68 68.11 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.691 0.282 . . . . 0.0 110.911 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.6 tt -64.97 -21.2 66.8 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.093 -178.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.516 ' O ' ' HD3' ' A' ' 20' ' ' PRO . 36.1 ttmt -69.53 -33.17 72.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.301 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.3 t -103.9 99.26 15.69 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-O 120.893 0.377 . . . . 0.0 110.288 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.516 ' HD3' ' O ' ' A' ' 18' ' ' LYS . 87.0 Cg_endo -93.82 0.19 3.21 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 122.869 2.38 . . . . 0.0 111.392 177.422 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 p -87.9 44.33 1.18 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.138 -176.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.711 ' HB2' ' HD2' ' A' ' 23' ' ' PRO . 79.2 p -174.04 171.46 1.54 Allowed Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.87 -0.605 . . . . 0.0 109.896 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.711 ' HD2' ' HB2' ' A' ' 22' ' ' SER . 9.3 Cg_endo -51.85 -21.2 11.27 Favored 'Trans proline' 0 C--N 1.35 0.633 0 C-N-CA 123.349 2.699 . . . . 0.0 113.11 175.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.421 ' HB3' ' OG1' ' A' ' 16' ' ' THR . 26.4 mt-30 -60.83 -26.25 67.19 Favored 'General case' 0 C--O 1.233 0.188 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -174.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.444 ' HB2' ' HA ' ' A' ' 20' ' ' PRO . 6.7 tt0 -60.31 -57.54 12.35 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.895 -0.322 . . . . 0.0 110.254 -179.169 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.43 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 48.3 mt-30 -78.45 -51.4 10.08 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 178.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 8.6 tm0? -69.82 -54.8 11.94 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.301 0.482 . . . . 0.0 112.301 -168.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -71.64 -49.12 42.91 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.418 -172.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.562 HG13 HD11 ' A' ' 13' ' ' LEU . 88.1 t -59.8 -39.89 81.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.999 -178.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 26' ' ' GLN . 32.2 tp -54.94 -46.61 74.97 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 120.798 0.332 . . . . 0.0 111.528 -178.165 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -68.29 -47.93 66.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.166 -178.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 62.8 mt -67.24 -39.01 82.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 CA-C-O 121.381 0.61 . . . . 0.0 110.244 -176.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.784 ' HG ' ' HG2' ' A' ' 40' ' ' MET . 22.2 tp -63.0 -38.4 91.04 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.253 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.681 ' HA ' ' HG3' ' A' ' 40' ' ' MET . 51.8 tttp -66.39 -28.47 68.66 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.05 0.452 . . . . 0.0 110.668 -179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 7.9 t -78.1 -9.83 59.34 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.216 179.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -116.87 81.95 12.64 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-N 115.734 -0.666 . . . . 0.0 109.67 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -55.45 -36.17 93.57 Favored 'Trans proline' 0 C--N 1.344 0.328 0 C-N-CA 123.356 2.704 . . . . 0.0 113.499 -171.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -59.24 -48.24 82.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.981 0.42 . . . . 0.0 111.143 -178.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.48 HD12 HD11 ' A' ' 33' ' ' LEU . 0.2 OUTLIER -76.08 -38.65 56.79 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.191 -177.41 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.784 ' HG2' ' HG ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -60.43 -46.03 91.5 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.64 179.515 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.61 -37.62 73.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.235 179.828 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -68.52 -45.56 71.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.045 0.45 . . . . 0.0 110.466 179.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -64.43 -42.8 95.81 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.717 179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 91.2 mt -64.24 -45.01 97.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.251 179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -65.09 -49.63 69.28 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.543 -177.212 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 55.0 mt-30 -81.13 -29.74 34.72 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.41 HH11 ' HD2' ' A' ' 47' ' ' ARG . 37.6 mtp85 56.94 37.7 28.95 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 -175.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 47' ' ' ARG . 61.7 m 72.09 -67.17 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.091 -0.959 . . . . 0.0 110.456 -172.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -178.32 91.41 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 122.758 0.423 . . . . 0.0 110.143 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.987 ' HE3' ' HA ' ' A' ' 50' ' ' LYS . 0.5 OUTLIER -120.48 -53.63 2.1 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 120.603 -0.439 . . . . 0.0 111.311 -178.383 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -88.51 -33.61 17.71 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.291 0.567 . . . . 0.0 109.765 178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.9 t -82.18 94.25 2.8 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.781 177.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -127.94 -63.93 0.99 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.064 -177.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -159.75 -58.43 0.06 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.533 -176.469 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.473 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 8.5 tp-100 -92.52 123.25 62.55 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.78 -173.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.473 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 14.7 Cg_endo -90.64 151.01 4.21 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 123.233 2.622 . . . . 0.0 111.611 174.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -78.11 83.33 1.19 Allowed Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.326 -178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.426 ' O ' ' HB3' ' A' ' 59' ' ' GLN . 28.1 ttt -65.54 141.43 58.46 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 110.539 -0.171 . . . . 0.0 110.539 179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 58' ' ' MET . 56.1 tt0 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.235 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo . . . . . 0 N--CA 1.478 0.58 0 N-CA-C 110.919 -0.454 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -112.39 -40.13 4.21 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.804 -179.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -85.8 101.97 13.27 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.703 -174.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 58.0 m 61.44 65.87 0.92 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.125 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 tp -69.68 137.93 23.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.76 178.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 19.6 m -58.95 131.81 86.81 Favored Pre-proline 0 N--CA 1.454 -0.267 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.79 177.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.637 ' HB2' ' HB3' ' A' ' 36' ' ' ASN . 33.5 Cg_exo -22.17 76.88 0.0 OUTLIER 'Trans proline' 0 C--N 1.35 0.629 1 C-N-CA 126.638 4.892 . . . . 0.0 116.744 -170.159 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.511 ' HA ' ' CG ' ' A' ' 11' ' ' GLN . 23.9 t -79.26 -19.74 49.83 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 169.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.92 -42.45 99.11 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 114.19 -1.368 . . . . 0.0 109.822 172.232 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.743 ' HB3' HG23 ' A' ' 32' ' ' ILE . 87.6 mt -71.42 -35.82 71.09 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.249 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.952 ' HA ' HD23 ' A' ' 14' ' ' LEU . 34.2 mm-40 -55.11 -32.44 62.03 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 121.535 0.683 . . . . 0.0 110.178 177.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 15' ' ' ARG . 1.8 t70 -61.38 -49.3 77.48 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-N 115.015 -0.993 . . . . 0.0 113.079 -176.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.051 ' HB2' HD11 ' A' ' 32' ' ' ILE . 37.0 mt -72.94 -36.63 67.24 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.739 -177.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.952 HD23 ' HA ' ' A' ' 11' ' ' GLN . 0.3 OUTLIER -56.48 -31.0 63.62 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.113 0.482 . . . . 0.0 110.432 178.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.577 ' HB2' ' O ' ' A' ' 12' ' ' ASP . 67.9 mtp180 -49.75 -23.16 1.67 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.297 174.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 13' ' ' LEU . 11.1 t -51.96 -31.39 28.89 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 114.184 -1.371 . . . . 0.0 111.149 -179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.982 ' HB3' HG21 ' A' ' 29' ' ' VAL . 2.8 pp -59.78 -18.84 46.46 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -175.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -70.56 -8.01 48.2 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.883 0.373 . . . . 0.0 111.203 -178.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.0 t -102.29 100.67 16.16 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 171.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -86.95 21.54 1.05 Allowed 'Trans proline' 0 N--CA 1.458 -0.586 0 C-N-CA 122.831 2.354 . . . . 0.0 112.479 -177.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 16.9 t -93.73 -9.17 38.57 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.265 0.555 . . . . 0.0 109.511 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -131.61 143.23 48.32 Favored Pre-proline 0 N--CA 1.449 -0.519 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.563 -175.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_endo -56.26 -17.07 19.36 Favored 'Trans proline' 0 C--N 1.351 0.659 0 C-N-CA 124.698 3.598 . . . . 0.0 112.886 176.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 66.1 mm-40 -59.0 -24.23 62.58 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.861 -172.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.848 ' HG3' ' HB2' ' A' ' 17' ' ' LEU . 6.3 tt0 -55.38 -56.24 22.38 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.754 -178.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.471 ' HG3' ' N ' ' A' ' 27' ' ' GLN . 2.2 pt20 -76.7 -50.38 13.79 Favored 'General case' 0 C--N 1.323 -0.543 0 C-N-CA 120.245 -0.582 . . . . 0.0 112.175 -176.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.506 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 4.9 tp60 -71.03 -54.04 12.6 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -170.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 7.1 tp60 -71.19 -38.89 72.07 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 120.796 0.332 . . . . 0.0 111.627 -171.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.982 HG21 ' HB3' ' A' ' 17' ' ' LEU . 91.2 t -65.07 -37.0 79.14 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.012 -178.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 57.6 tp -61.41 -39.27 90.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.078 0.466 . . . . 0.0 110.279 175.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 47.6 t30 -67.25 -44.68 78.8 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.492 179.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 1.051 HD11 ' HB2' ' A' ' 13' ' ' LEU . 1.7 mt -59.85 -45.56 94.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.237 0.541 . . . . 0.0 110.215 174.018 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.82 ' HG ' ' SD ' ' A' ' 40' ' ' MET . 1.8 tp -59.35 -44.94 92.6 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.046 -0.979 . . . . 0.0 111.537 -173.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -70.03 -25.94 63.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.713 0.292 . . . . 0.0 110.975 178.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.449 ' O ' ' HD3' ' A' ' 37' ' ' PRO . 48.2 m -74.02 -29.22 61.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.475 -0.329 . . . . 0.0 111.038 179.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.637 ' HB3' ' HB2' ' A' ' 7' ' ' PRO . 0.3 OUTLIER -111.81 86.99 7.8 Favored Pre-proline 0 CA--C 1.535 0.369 0 CA-C-O 121.734 0.778 . . . . 0.0 110.711 173.978 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.449 ' HD3' ' O ' ' A' ' 35' ' ' SER . 50.8 Cg_exo -54.54 -32.99 76.68 Favored 'Trans proline' 0 C--N 1.347 0.452 0 C-N-CA 123.609 2.873 . . . . 0.0 114.426 -172.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 8.7 tp-100 -59.14 -47.87 83.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.747 0.308 . . . . 0.0 111.434 -177.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.679 HD12 HD11 ' A' ' 33' ' ' LEU . 0.6 OUTLIER -75.85 -35.6 59.88 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 -179.412 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.82 ' SD ' ' HG ' ' A' ' 33' ' ' LEU . 2.1 tpt -59.97 -37.27 79.12 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.844 177.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' O ' ' HG3' ' A' ' 45' ' ' LYS . . . -55.48 -49.51 72.32 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.557 176.1 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -67.11 -38.13 85.11 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.954 -179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -64.4 -41.28 96.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.941 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.451 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 80.1 mt -66.63 -35.76 75.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.733 177.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.458 ' HG3' ' O ' ' A' ' 41' ' ' ALA . 66.8 mttm -70.89 -44.81 65.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.367 178.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -74.97 -48.33 24.84 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.962 -177.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 44' ' ' ILE . 16.0 mmt180 59.42 107.4 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.128 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.2 p -78.42 46.79 0.65 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.553 0.692 . . . . 0.0 109.571 167.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.748 ' HB1' ' HB ' ' A' ' 52' ' ' VAL . . . -77.09 -46.03 24.98 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.425 -167.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HB2' ' NZ ' ' A' ' 50' ' ' LYS . 4.3 ttmp? 67.48 88.35 0.11 Allowed 'General case' 0 C--O 1.234 0.267 0 O-C-N 123.41 0.444 . . . . 0.0 110.664 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.425 ' HD2' ' HG2' ' A' ' 50' ' ' LYS . 97.3 m-85 66.05 57.0 0.81 Allowed 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.213 178.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.748 ' HB ' ' HB1' ' A' ' 49' ' ' ALA . 9.8 p -97.05 -16.17 7.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.303 0.573 . . . . 0.0 110.317 178.009 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -76.1 82.0 2.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.824 -178.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -68.6 -32.69 72.76 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.379 178.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -85.96 133.28 41.57 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.572 178.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -81.65 -1.09 10.78 Favored 'Trans proline' 0 N--CA 1.462 -0.347 0 C-N-CA 122.654 2.236 . . . . 0.0 111.543 175.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.17 -100.06 2.04 Favored Glycine 0 N--CA 1.447 -0.624 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.807 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -85.7 135.92 33.57 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 110.093 -0.336 . . . . 0.0 110.093 178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 C--O 1.246 0.889 0 CA-C-O 118.9 -0.571 . . . . 0.0 109.553 177.615 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_endo . . . . . 0 N--CA 1.48 0.71 0 N-CA-C 110.736 -0.524 . . . . 0.0 110.736 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -109.26 99.58 8.83 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.58 -0.282 . . . . 0.0 110.616 -179.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 67.1 ttt180 67.42 -68.95 0.14 Allowed 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.958 0.903 . . . . 0.0 111.47 -178.103 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.6 t -82.85 111.47 18.78 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.513 HG21 ' HB2' ' A' ' 36' ' ' ASN . 66.5 mt -70.95 121.77 21.51 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.053 0.454 . . . . 0.0 110.747 -178.01 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 10.4 m -66.37 120.57 71.3 Favored Pre-proline 0 C--N 1.325 -0.499 0 CA-C-N 115.423 -0.808 . . . . 0.0 111.855 -175.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.727 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 33.8 Cg_exo -62.37 -15.43 45.02 Favored 'Trans proline' 0 C--N 1.346 0.427 0 C-N-CA 123.516 2.811 . . . . 0.0 112.762 179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.3 t -60.16 -22.83 63.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.531 177.477 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.23 -47.29 77.34 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.029 178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.727 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.9 pp -69.69 -38.41 77.0 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 121.102 0.477 . . . . 0.0 110.552 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -59.35 -43.07 92.84 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.929 174.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.479 ' O ' HG23 ' A' ' 16' ' ' THR . 38.9 t70 -70.42 -31.27 68.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.426 . . . . 0.0 110.055 176.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.744 ' HB2' HG21 ' A' ' 32' ' ' ILE . 62.3 tp -59.13 -40.38 85.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.86 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 10.5 mt -56.31 -38.59 71.49 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.505 0.669 . . . . 0.0 109.592 179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 12.5 mmt85 -71.79 -42.5 67.02 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 114.754 -1.112 . . . . 0.0 111.428 177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.615 HG22 ' HB3' ' A' ' 28' ' ' GLN . 71.6 p -65.89 -36.23 82.82 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.059 0.457 . . . . 0.0 111.753 -174.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.685 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 93.5 mt -59.67 -6.5 1.19 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.289 -0.869 . . . . 0.0 113.119 -172.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -65.73 12.69 0.05 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.323 0.582 . . . . 0.0 111.124 173.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.918 ' HB2' ' HD2' ' A' ' 20' ' ' PRO . 13.1 p -43.06 165.59 0.11 Allowed Pre-proline 0 CA--C 1.543 0.707 0 C-N-CA 125.61 1.564 . . . . 0.0 113.062 172.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.918 ' HD2' ' HB2' ' A' ' 19' ' ' SER . 0.5 OUTLIER 9.24 76.41 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.478 1 C-N-CA 125.762 4.308 . . . . 0.0 114.57 -152.408 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 33.4 t 172.22 -34.75 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.741 0 CA-C-N 111.385 -2.643 . . . . 0.0 104.74 -178.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 30.9 m -134.86 153.19 78.55 Favored Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 113.467 -1.697 . . . . 0.0 109.173 171.059 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -57.58 -15.4 20.13 Favored 'Trans proline' 0 N--CA 1.486 1.062 0 C-N-CA 124.926 3.751 . . . . 0.0 114.248 -178.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.52 ' HA ' HE21 ' A' ' 28' ' ' GLN . 43.4 mt-30 -59.44 -21.6 60.25 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 -163.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.652 ' HB2' ' CB ' ' A' ' 19' ' ' SER . 45.2 tp60 -54.51 -57.34 11.75 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -171.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -69.98 -52.22 26.13 Favored 'General case' 0 C--N 1.325 -0.469 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.865 -169.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 77.6 mt-30 -74.17 -57.87 3.67 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.615 ' HB3' HG22 ' A' ' 16' ' ' THR . 2.0 mp0 -76.71 -51.54 11.28 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -169.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.53 HG22 ' CB ' ' A' ' 16' ' ' THR . 32.2 t -67.57 -45.56 84.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.734 -173.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.4 tt -57.83 -38.46 75.66 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.423 -179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -64.19 -38.47 91.17 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.194 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.744 HG21 ' HB2' ' A' ' 13' ' ' LEU . 61.7 mt -77.2 -43.92 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.651 -176.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.967 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 3.5 mm? -56.94 -33.91 67.47 Favored 'General case' 0 C--O 1.214 -0.774 0 CA-C-O 121.205 0.526 . . . . 0.0 110.163 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.9 tmtt? -64.17 -25.38 68.05 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.513 0.56 . . . . 0.0 112.513 -177.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.5 m -87.08 -23.69 24.84 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -170.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.741 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 27.6 t-20 -169.59 -47.38 0.0 OUTLIER Pre-proline 0 N--CA 1.482 1.172 0 O-C-N 122.218 -0.301 . . . . 0.0 110.627 -172.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.967 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 96.3 Cg_exo -48.01 2.68 0.02 OUTLIER 'Trans proline' 0 CA--C 1.542 0.879 1 C-N-CA 125.473 4.115 . . . . 0.0 114.729 161.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.604 ' H ' ' C ' ' A' ' 36' ' ' ASN . 45.7 mt-30 -44.6 -13.81 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 126.997 2.119 . . . . 0.0 114.572 -162.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.466 HD13 ' O ' ' A' ' 39' ' ' LEU . 2.0 tm? -47.76 -33.61 7.35 Favored 'General case' 0 CA--C 1.55 0.946 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 170.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.78 ' HB2' HD12 ' A' ' 33' ' ' LEU . 37.6 ttp -61.18 -31.48 71.22 Favored 'General case' 0 N--CA 1.475 0.778 0 O-C-N 121.986 -0.446 . . . . 0.0 111.564 175.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -57.19 -43.19 82.44 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.638 -0.425 . . . . 0.0 109.89 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.36 -37.55 77.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.093 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.762 ' HD2' ' HG3' ' A' ' 40' ' ' MET . 6.2 t80 -56.62 -44.19 80.94 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.292 177.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.509 HD11 ' HE3' ' A' ' 40' ' ' MET . 64.8 mt -67.88 -46.16 82.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.751 0.31 . . . . 0.0 110.85 177.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -64.82 -36.28 83.82 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.161 -178.102 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -74.79 -30.02 61.29 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.346 178.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 47' ' ' ARG . 26.0 ttt180 57.54 67.08 1.02 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.509 0.671 . . . . 0.0 109.969 -177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 m -76.42 160.91 29.11 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.93 -1.032 . . . . 0.0 110.313 179.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 63.29 37.21 11.19 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.032 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -63.02 -17.89 62.72 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.263 -179.118 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 63.2 t80 -66.72 -27.27 67.49 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.372 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 7.6 p -149.45 -40.96 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.616 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -174.277 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . 62.73 -91.35 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 122.872 0.469 . . . . 0.0 110.18 -172.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -131.93 -18.18 2.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.134 0.492 . . . . 0.0 110.54 177.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -112.78 121.68 37.96 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.154 -175.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -59.06 140.46 95.32 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.65 2.233 . . . . 0.0 111.449 176.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -115.5 45.94 1.23 Allowed Glycine 0 N--CA 1.447 -0.594 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.72 -175.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 94.1 mmm -80.39 121.77 26.12 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 110.041 -0.355 . . . . 0.0 110.041 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 52.7 tp60 . . . . . 0 C--O 1.247 0.95 0 CA-C-O 118.553 -0.737 . . . . 0.0 109.358 177.464 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo . . . . . 0 N--CA 1.48 0.721 0 N-CA-C 111.027 -0.413 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 3' ' ' ARG . 7.3 t-20 60.24 -152.02 0.4 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 -179.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.431 ' HB3' ' O ' ' A' ' 2' ' ' ASN . 39.0 ttm180 71.67 -65.11 0.36 Allowed 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 122.887 0.475 . . . . 0.0 110.315 -177.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.8 p -88.53 126.49 35.29 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.7 pt -62.22 131.88 27.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.345 0 CA-C-O 121.018 0.437 . . . . 0.0 111.176 -177.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.408 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 4.0 m -60.22 121.28 58.33 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.941 -179.106 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.607 ' O ' ' HG ' ' A' ' 10' ' ' LEU . 31.3 Cg_exo -62.32 -24.81 76.12 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.749 2.299 . . . . 0.0 111.892 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.6 m -69.27 -19.2 63.92 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.35 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.03 -46.57 64.78 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.719 0.295 . . . . 0.0 110.831 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 7' ' ' PRO . 3.7 pp -70.65 -36.91 73.63 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.251 0.548 . . . . 0.0 110.837 -178.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 18.5 mm-40 -61.01 -49.22 78.3 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.51 176.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.417 ' O ' ' HB ' ' A' ' 16' ' ' THR . 9.2 t70 -65.9 -28.63 69.08 Favored 'General case' 0 C--O 1.221 -0.414 0 CA-C-O 121.564 0.697 . . . . 0.0 109.789 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.726 HD12 HG22 ' A' ' 32' ' ' ILE . 7.3 tt -59.77 -50.86 72.17 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.642 -1.163 . . . . 0.0 111.513 -175.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.436 ' H ' ' HG ' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -74.09 -38.11 63.99 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 122.952 1.358 . . . . 0.0 110.189 178.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.647 ' O ' ' HB3' ' A' ' 19' ' ' SER . 19.4 ttm180 -70.79 -26.8 63.48 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 112.409 -2.178 . . . . 0.0 112.707 -172.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 13' ' ' LEU . 9.9 t -64.32 -47.86 77.8 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -161.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 1.022 HD13 ' HG3' ' A' ' 18' ' ' LYS . 0.9 OUTLIER -79.25 -53.52 6.87 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 119.378 -0.929 . . . . 0.0 112.848 -162.099 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 1.039 ' HB3' ' HB2' ' A' ' 22' ' ' SER 0.281 70.2 mttt -127.42 21.85 6.57 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 -174.107 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.647 ' HB3' ' O ' ' A' ' 15' ' ' ARG . 7.0 p -28.85 140.98 0.09 OUTLIER Pre-proline 0 N--CA 1.477 0.915 0 N-CA-C 116.729 2.122 . . . . 0.0 116.729 -135.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -11.85 77.4 0.0 OUTLIER 'Trans proline' 0 C--N 1.363 1.311 1 C-N-CA 128.407 6.072 . . . . 0.0 117.668 -163.559 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -167.84 8.12 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.029 -0.987 . . . . 0.0 109.668 167.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 1.039 ' HB2' ' HB3' ' A' ' 18' ' ' LYS . 12.5 m -152.7 179.54 1.25 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -164.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.807 ' HD2' ' HB3' ' A' ' 22' ' ' SER . 67.6 Cg_exo -46.49 -6.46 0.03 OUTLIER 'Trans proline' 0 N--CA 1.491 1.343 1 C-N-CA 126.691 4.927 . . . . 0.0 118.135 172.487 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 1.021 ' HB3' ' HB2' ' A' ' 18' ' ' LYS . 4.4 pm0 -51.49 -21.97 2.8 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 116.134 1.901 . . . . 0.0 116.134 -153.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.671 ' O ' ' HB ' ' A' ' 29' ' ' VAL . 53.2 tt0 -52.69 -41.73 64.13 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 -167.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -79.75 -54.35 5.93 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 116.181 1.919 . . . . 0.0 116.181 -174.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -70.16 -65.86 0.67 Allowed 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 -155.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.789 ' H ' ' HG ' ' A' ' 17' ' ' LEU . 8.1 mm100 -79.49 -34.35 41.4 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.874 0.845 . . . . 0.0 110.705 176.729 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.671 ' HB ' ' O ' ' A' ' 25' ' ' GLN . 59.8 t -65.23 -41.18 90.93 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 CA-C-N 113.886 -1.506 . . . . 0.0 111.794 -168.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.549 ' O ' ' HG3' ' A' ' 34' ' ' LYS . 33.8 tp -62.08 -32.97 73.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.858 0.361 . . . . 0.0 110.418 177.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -67.8 -47.29 69.52 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.722 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.726 HG22 HD12 ' A' ' 13' ' ' LEU . 32.9 mt -65.93 -31.53 54.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.178 0 CA-C-O 121.409 0.623 . . . . 0.0 109.587 176.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.736 ' HG ' ' HG3' ' A' ' 40' ' ' MET . 2.3 tp -57.47 -37.16 72.42 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.046 175.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 30' ' ' LEU . 60.4 mttp -68.86 -34.47 75.5 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.756 178.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.8 p -80.81 2.37 26.61 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.541 -0.3 . . . . 0.0 111.745 -176.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.446 ' OD1' ' HB2' ' A' ' 39' ' ' LEU . 14.7 t-20 -132.3 80.47 63.38 Favored Pre-proline 0 C--N 1.322 -0.629 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 169.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 36' ' ' ASN . 9.9 Cg_endo -52.65 -32.89 56.55 Favored 'Trans proline' 0 N--CA 1.463 -0.313 0 C-N-CA 123.465 2.777 . . . . 0.0 113.738 -174.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 27.8 mm-40 -70.2 -45.98 65.51 Favored 'General case' 0 C--N 1.331 -0.224 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.521 -177.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.446 ' HB2' ' OD1' ' A' ' 36' ' ' ASN . 1.0 OUTLIER -65.2 -42.09 93.87 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.592 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.736 ' HG3' ' HG ' ' A' ' 33' ' ' LEU . 11.1 ttt -66.86 -39.95 87.7 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.927 -0.578 . . . . 0.0 110.268 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -56.63 -43.64 80.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.651 176.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -66.17 -45.76 79.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.933 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -63.46 -44.08 95.48 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.097 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.498 ' HA ' ' OG1' ' A' ' 48' ' ' THR . 85.8 mt -70.77 -42.76 77.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.919 0.39 . . . . 0.0 111.11 -177.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 7.7 ttpm? -70.94 -44.9 65.16 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.432 -178.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.454 ' HG3' ' HG3' ' A' ' 47' ' ' ARG . 6.9 tp-100 -73.78 -46.68 44.0 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.738 -176.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.454 ' HG3' ' HG3' ' A' ' 46' ' ' GLN . 98.1 mtt180 -126.95 -120.63 0.25 Allowed 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.477 -0.194 . . . . 0.0 110.477 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.498 ' OG1' ' HA ' ' A' ' 44' ' ' ILE . 38.0 m 53.51 83.24 0.07 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.115 0.483 . . . . 0.0 111.418 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . 62.59 10.03 3.85 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.965 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.0 mtmp? -133.93 61.21 1.68 Allowed 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 179.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -87.02 69.65 10.24 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.344 -0.844 . . . . 0.0 108.8 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 t 59.21 39.07 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.175 0 CA-C-O 122.467 1.127 . . . . 0.0 108.533 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -139.48 167.07 22.92 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 114.102 -1.408 . . . . 0.0 108.885 -178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -132.84 109.5 9.67 Favored 'General case' 0 C--N 1.319 -0.754 0 C-N-CA 120.528 -0.469 . . . . 0.0 111.242 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.478 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 4.7 tt0 -91.62 122.97 64.89 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.236 173.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 7.7 Cg_exo -73.99 46.4 1.31 Allowed 'Trans proline' 0 CA--C 1.532 0.397 0 C-N-CA 123.149 2.566 . . . . 0.0 112.527 -179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -163.44 175.77 39.66 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 111.618 -0.593 . . . . 0.0 111.618 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -85.32 139.37 31.64 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.67 0.235 . . . . 0.0 110.966 -178.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 . . . . . 0 C--O 1.251 1.135 0 O-C-N 124.069 0.856 . . . . 0.0 111.653 177.65 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 N--CA 1.476 0.458 0 N-CA-C 110.353 -0.672 . . . . 0.0 110.353 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 34.0 m-80 -122.92 -64.88 1.14 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.224 -178.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 3' ' ' ARG . 32.6 mmt180 62.51 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.348 0 O-C-N 124.101 0.876 . . . . 0.0 112.696 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.8 p -73.78 106.12 5.38 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.156 174.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 57.6 mt -68.07 125.19 25.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.406 ' HA ' ' HD2' ' A' ' 7' ' ' PRO . 47.8 m -65.16 116.86 34.16 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.435 -173.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 6' ' ' SER . 30.3 Cg_endo -64.23 -25.03 65.05 Favored 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 122.914 2.409 . . . . 0.0 112.181 -178.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.9 m -60.37 -44.66 95.41 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.2 0.524 . . . . 0.0 110.352 177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.54 -39.08 74.23 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.505 178.587 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.716 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 95.8 mt -65.34 -46.5 79.99 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.31 -178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 pp0? -65.23 -38.7 91.22 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.127 0.489 . . . . 0.0 110.759 -176.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.499 ' HA ' ' HD2' ' A' ' 15' ' ' ARG . 36.3 t70 -70.21 -30.92 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.141 177.35 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.831 HD11 HG13 ' A' ' 29' ' ' VAL . 53.3 tp -64.88 -40.66 95.47 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.125 175.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.716 ' HG ' ' O ' ' A' ' 10' ' ' LEU . 12.7 mt -64.51 -36.98 85.97 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.888 178.041 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.499 ' HD2' ' HA ' ' A' ' 12' ' ' ASP . 96.2 mtt180 -54.96 -51.83 64.93 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.479 -0.782 . . . . 0.0 111.353 179.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.462 ' OG1' ' HB2' ' A' ' 24' ' ' GLN . 11.5 t -73.45 -38.03 65.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.151 -176.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 tt -69.16 -31.87 70.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.767 -179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.8 tppp? -72.51 -17.39 61.74 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.563 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.416 ' HA ' ' HD3' ' A' ' 20' ' ' PRO . 17.1 m -101.94 101.21 17.43 Favored Pre-proline 0 C--N 1.324 -0.543 0 CA-C-N 116.017 -0.538 . . . . 0.0 109.971 178.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 19' ' ' SER . 4.8 Cg_exo -76.49 81.39 2.51 Favored 'Trans proline' 0 N--CA 1.457 -0.676 0 C-N-CA 122.94 2.427 . . . . 0.0 113.107 -172.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.58 ' HB3' ' HG2' ' A' ' 24' ' ' GLN . 23.3 t -131.55 131.41 43.33 Favored 'General case' 0 C--N 1.315 -0.934 0 N-CA-C 107.611 -1.255 . . . . 0.0 107.611 169.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.528 ' HB3' ' HD3' ' A' ' 23' ' ' PRO . 9.6 t -44.07 -51.82 17.38 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.928 0.714 . . . . 0.0 112.928 -172.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.528 ' HD3' ' HB3' ' A' ' 22' ' ' SER . 38.7 Cg_exo -62.2 -47.58 9.82 Favored 'Trans proline' 0 C--N 1.355 0.889 0 C-N-CA 121.433 1.422 . . . . 0.0 113.557 -177.523 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.661 ' O ' ' HB3' ' A' ' 28' ' ' GLN . 26.3 pt20 -75.46 -36.81 60.61 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 119.749 -0.781 . . . . 0.0 111.333 -177.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -72.45 -55.58 6.79 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.02 -177.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -78.06 -54.71 5.96 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -177.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.527 ' HB2' ' O ' ' A' ' 23' ' ' PRO . 49.5 mt-30 -72.88 -53.27 11.83 Favored 'General case' 0 N--CA 1.464 0.233 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -173.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLN . . . . . 0.661 ' HB3' ' O ' ' A' ' 24' ' ' GLN . 58.7 tp60 -63.87 -45.8 87.79 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.293 -174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.831 HG13 HD11 ' A' ' 13' ' ' LEU . 53.7 t -59.58 -44.05 92.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-O 120.668 0.271 . . . . 0.0 110.863 179.077 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 49.4 tp -58.25 -45.57 87.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.735 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -67.72 -44.77 76.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.766 HG22 ' HG2' ' A' ' 37' ' ' PRO . 71.1 mt -59.62 -42.73 89.27 Favored 'Isoleucine or valine' 0 C--O 1.232 0.174 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 177.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.985 ' HA ' ' HB2' ' A' ' 37' ' ' PRO . 34.3 mt -54.9 -31.47 60.07 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.873 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -72.26 -26.88 62.17 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 -177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 80.2 p -81.23 -28.06 34.98 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.057 1.132 . . . . 0.0 114.057 -168.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.635 ' HB3' ' HD3' ' A' ' 37' ' ' PRO . 18.0 t-20 -169.81 -42.63 0.0 OUTLIER Pre-proline 0 N--CA 1.478 0.973 0 CA-C-O 121.151 0.501 . . . . 0.0 109.955 -171.112 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.985 ' HB2' ' HA ' ' A' ' 33' ' ' LEU . 66.3 Cg_exo -46.88 -1.15 0.02 OUTLIER 'Trans proline' 0 CA--C 1.537 0.668 0 C-N-CA 124.863 3.708 . . . . 0.0 114.203 156.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.581 ' H ' ' C ' ' A' ' 36' ' ' ASN . 11.0 pt20 -44.98 -11.05 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 126.161 1.784 . . . . 0.0 112.891 -176.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 39' ' ' LEU . 3.2 tm? -44.89 -31.78 1.37 Allowed 'General case' 0 C--N 1.315 -0.914 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 162.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' MET . . . . . 0.841 ' HG2' ' HB3' ' A' ' 33' ' ' LEU . 4.5 ppp? -54.51 -31.01 55.33 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.878 0.871 . . . . 0.0 111.193 174.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -55.31 -42.51 73.83 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.378 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -69.35 -37.56 77.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.61 175.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 16.8 t80 -61.18 -44.71 96.87 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.669 178.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.46 HD13 ' O ' ' A' ' 40' ' ' MET . 1.6 mp -62.87 -47.26 93.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.593 177.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -60.71 -38.76 86.13 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.371 177.02 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 26.0 tp60 -69.5 -21.16 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.307 0.575 . . . . 0.0 109.845 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 24.6 ttm180 63.29 35.56 12.38 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 114.643 -1.162 . . . . 0.0 111.151 173.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 3.5 m 55.63 39.1 30.9 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.238 176.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -82.41 62.32 6.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.782 -176.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 10.7 mtmp? -103.2 113.87 27.69 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 173.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -80.6 4.3 19.01 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.086 -0.507 . . . . 0.0 111.474 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.5 t 67.22 102.21 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.609 177.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -90.39 149.65 22.19 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.558 174.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -74.96 62.86 1.16 Allowed 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.059 0.456 . . . . 0.0 111.043 -179.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.479 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 6.5 tt0 -110.63 120.94 42.55 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.86 -179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.479 ' HD3' ' HA ' ' A' ' 55' ' ' GLN . 10.7 Cg_exo -71.84 68.75 3.03 Favored 'Trans proline' 0 CA--C 1.528 0.211 0 C-N-CA 122.929 2.419 . . . . 0.0 112.149 178.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.47 146.88 18.36 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 121.025 -0.607 . . . . 0.0 111.817 178.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 83.4 mtp -87.66 123.57 32.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.9 0.381 . . . . 0.0 110.458 -179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 61.4 tt0 . . . . . 0 C--O 1.246 0.913 0 CA-C-O 118.648 -0.691 . . . . 0.0 109.59 -179.325 . . . . . . . . 0 0 . 1 stop_ save_