data_1o8y_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 1o8y _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 10' ' ' ILE . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.447 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.447 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.409 HD11 HG22 ' A' ' 10' ' ' ILE . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.403 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.446 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.442 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.454 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.454 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.449 HD11 HG22 ' A' ' 10' ' ' ILE . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.449 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.465 HD11 HG22 ' A' ' 10' ' ' ILE . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.446 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 10' ' ' ILE . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.417 ' O ' HG22 ' A' ' 4' ' ' THR . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.438 HG23 HD11 ' A' ' 10' ' ' ILE . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.444 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 5' ' ' LYS . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 10' ' ' ILE . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.458 ' O ' HD12 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.458 HD12 ' O ' ' A' ' 9' ' ' PRO . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.52 ' CG2' ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.52 ' HD2' ' CG2' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.523 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.526 ' CG2' ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HD2' ' CG2' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.564 HG23 ' CZ ' ' A' ' 12' ' ' PHE . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.564 ' CZ ' HG23 ' A' ' 10' ' ' ILE . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.448 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.434 HD11 HG22 ' A' ' 10' ' ' ILE . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.424 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.424 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.458 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.447 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.447 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.409 HD11 HG22 ' A' ' 10' ' ' ILE . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.403 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.445 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.446 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.442 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.442 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.46 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.453 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.46 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.451 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.454 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.454 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.449 HD11 HG22 ' A' ' 10' ' ' ILE . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.454 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.449 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.449 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.457 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.457 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.422 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.465 HD11 HG22 ' A' ' 10' ' ' ILE . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.446 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.417 HG22 ' O ' ' A' ' 10' ' ' ILE . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.417 ' O ' HG22 ' A' ' 4' ' ' THR . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.454 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.458 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.438 HG23 HD11 ' A' ' 10' ' ' ILE . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.446 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.444 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.444 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.444 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.408 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.419 ' O ' ' C ' ' A' ' 5' ' ' LYS . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.412 HD11 HG22 ' A' ' 10' ' ' ILE . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.458 ' O ' HD12 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.458 HD12 ' O ' ' A' ' 9' ' ' PRO . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.408 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.52 ' CG2' ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' HD2' ' CG2' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.461 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.523 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.526 ' CG2' ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.526 ' HD2' ' CG2' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.564 HG23 ' CZ ' ' A' ' 12' ' ' PHE . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.564 ' CZ ' HG23 ' A' ' 10' ' ' ILE . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.44 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 10' ' ' ILE . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 4' ' ' THR . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.457 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.456 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.461 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.472 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.464 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.428 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.467 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.467 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.467 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.423 ' HG1' ' H ' ' A' ' 10' ' ' ILE . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 10' ' ' ILE . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.768 HG23 ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.768 ' HD2' HG23 ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.532 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.758 HG23 ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.758 ' HD2' HG23 ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.532 ' HB ' ' CG2' ' A' ' 4' ' ' THR . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 10' ' ' ILE . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 4' ' ' THR . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.457 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.456 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.461 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.472 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.464 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.428 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.467 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.467 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.467 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.423 ' HG1' ' H ' ' A' ' 10' ' ' ILE . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 10' ' ' ILE . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.768 HG23 ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.768 ' HD2' HG23 ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.532 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.758 HG23 ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.758 ' HD2' HG23 ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.532 ' HB ' ' CG2' ' A' ' 4' ' ' THR . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 10' ' ' ILE . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 4' ' ' THR . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.457 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.456 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.461 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.472 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.464 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.428 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.467 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.467 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.467 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.423 ' HG1' ' H ' ' A' ' 10' ' ' ILE . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 10' ' ' ILE . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.768 HG23 ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.768 ' HD2' HG23 ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.532 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.758 HG23 ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.758 ' HD2' HG23 ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.532 ' HB ' ' CG2' ' A' ' 4' ' ' THR . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.471 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.283 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.475 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 68.7 mtp180 -129.73 144.44 51.29 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.269 -1.136 . . . . 0.0 110.226 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 77.1 m -122.6 159.14 28.44 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.236 -0.915 . . . . 0.0 110.203 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 44.3 p -84.93 166.84 16.46 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.191 -0.943 . . . . 0.0 110.199 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 37.9 mttp . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.188 179.983 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 9.9 m . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.26 0.552 . . . . 5.0 110.201 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.4 pt -57.64 156.54 17.0 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.22 -0.925 . . . . 5.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.49 160.89 25.98 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.698 1.367 . . . . 5.0 110.541 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 150.47 84.9 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.697 1.367 . . . . 5.0 110.538 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 68.2 mt -119.09 135.56 59.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 O-C-N 121.235 -0.916 . . . . 5.0 110.231 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.0 m -109.53 153.11 24.58 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.272 -0.892 . . . . 0.0 110.214 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.456 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -116.91 162.13 28.97 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.276 -0.89 . . . . 0.0 110.207 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.45 -11.99 22.21 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.701 1.369 . . . . 0.0 110.548 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.5 p30 . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.256 -0.902 . . . . 0.0 110.213 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.211 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -120.14 137.11 54.35 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.299 -1.118 . . . . 0.0 110.17 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 71.1 m -125.93 163.53 22.76 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.186 -0.946 . . . . 0.0 110.22 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 69.8 p -79.89 158.36 26.71 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.257 -0.902 . . . . 0.0 110.162 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 68.4 tttt . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 118.045 -0.979 . . . . 0.0 110.192 -179.981 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.259 0.552 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.409 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.2 pt -128.75 152.11 78.28 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.273 -0.892 . . . . 0.0 110.164 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.54 164.91 14.45 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.729 1.383 . . . . 0.0 110.48 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 150.9 83.08 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.724 1.381 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.43 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 67.7 mt -106.32 133.84 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.164 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 56.4 m -118.02 156.24 28.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.222 -0.924 . . . . 0.0 110.289 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.0 m-85 -118.27 164.58 19.59 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.919 . . . . 0.0 110.193 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.42 -14.53 35.37 Favored 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.739 1.389 . . . . 0.0 110.572 179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 48.9 p30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.321 -0.862 . . . . 0.0 110.186 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.426 -1.47 . . . . 0.0 109.426 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.455 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 63.5 mtp180 -121.4 144.25 48.77 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.223 -1.163 . . . . 0.0 110.175 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 59.6 m -125.99 158.22 35.85 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.239 -0.913 . . . . 0.0 110.21 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.439 ' O ' ' HB3' ' A' ' 9' ' ' PRO . 17.5 p -115.28 166.82 11.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.266 -0.896 . . . . 0.0 110.146 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 pttm . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.935 -1.031 . . . . 0.0 110.21 -179.984 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 121.235 0.54 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.1 pt -54.79 158.19 4.72 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.183 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.45 152.77 70.8 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.74 1.389 . . . . 0.0 110.52 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.439 ' HB3' ' O ' ' A' ' 4' ' ' THR . 3.0 Cg_exo -61.47 150.17 86.38 Favored 'Trans proline' 0 C--N 1.312 -1.373 0 O-C-N 123.768 1.404 . . . . 0.0 110.553 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 72.5 mt -112.74 138.68 41.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.202 -0.936 . . . . 0.0 110.141 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 61.4 m -120.75 153.0 37.6 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.299 -0.876 . . . . 0.0 110.186 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 53.6 m-85 -124.08 161.87 44.72 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.31 -0.869 . . . . 0.0 110.209 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.38 -12.08 22.38 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.734 1.386 . . . . 0.0 110.539 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.455 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 50.4 p30 . . . . . 0 N--CA 1.491 1.62 0 O-C-N 121.281 -0.887 . . . . 0.0 110.234 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.292 0 N-CA-C 109.489 -1.445 . . . . 0.0 109.489 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.436 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 60.4 mtt180 -126.74 141.2 51.91 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.257 -1.143 . . . . 0.0 110.175 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.6 m -124.9 158.15 34.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.265 -0.897 . . . . 0.0 110.18 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 10' ' ' ILE . 20.8 p -82.23 164.01 21.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.241 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 12.0 mtmm . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.236 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 3.2 m . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.198 0.523 . . . . 0.0 110.21 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.7 pt -127.86 160.03 63.32 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.25 -0.906 . . . . 0.0 110.226 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 3.0 Cg_exo -61.43 156.09 48.62 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.713 1.375 . . . . 0.0 110.571 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.41 150.57 84.47 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.688 1.362 . . . . 0.0 110.578 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.472 ' O ' HG23 ' A' ' 4' ' ' THR . 70.7 mt -117.59 138.88 46.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.283 -0.886 . . . . 0.0 110.223 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 60.3 m -99.45 155.01 17.77 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.159 -0.963 . . . . 0.0 110.142 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 20.5 m-85 -117.98 161.87 32.31 Favored Pre-proline 0 N--CA 1.491 1.578 0 O-C-N 121.243 -0.91 . . . . 0.0 110.276 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.37 -12.03 22.13 Favored 'Trans proline' 0 C--N 1.31 -1.475 0 O-C-N 123.669 1.352 . . . . 0.0 110.47 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 53.7 p30 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.294 -0.879 . . . . 0.0 110.202 -179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -117.05 134.31 54.91 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.251 -1.146 . . . . 0.0 110.192 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 74.6 m -127.48 157.88 38.9 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.247 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.7 p -109.56 162.06 14.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.25 -0.906 . . . . 0.0 110.139 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 70.9 mttt . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 117.985 -1.007 . . . . 0.0 110.214 -179.971 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.252 0.549 . . . . 0.0 110.217 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.457 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 10.3 pt -116.07 163.75 20.32 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.269 -0.894 . . . . 0.0 110.245 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.457 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.39 154.04 61.66 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.703 1.37 . . . . 0.0 110.515 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.46 152.12 75.2 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.709 1.373 . . . . 0.0 110.528 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 87.6 mt -130.7 131.07 64.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.227 -0.921 . . . . 0.0 110.209 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.0 m -115.64 151.68 34.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.271 -0.893 . . . . 0.0 110.219 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -121.3 161.38 41.33 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.194 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.29 -12.1 22.15 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 O-C-N 123.666 1.35 . . . . 0.0 110.557 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.4 p30 . . . . . 0 N--CA 1.492 1.654 0 O-C-N 121.254 -0.904 . . . . 0.0 110.211 -179.961 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.462 -1.455 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.9 mtm180 -123.29 146.81 47.58 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.333 -1.098 . . . . 0.0 110.174 -179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 75.3 m -123.06 158.79 29.82 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.266 -0.897 . . . . 0.0 110.255 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.8 p -91.12 171.15 9.45 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.227 -0.921 . . . . 0.0 110.124 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 59.9 mttt . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.167 -179.947 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.249 0.547 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.456 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.8 pt -115.25 163.82 18.94 Favored Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.215 -0.928 . . . . 0.0 110.299 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.456 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.36 158.38 36.07 Favored 'Trans proline' 0 C--N 1.31 -1.48 0 O-C-N 123.711 1.374 . . . . 0.0 110.519 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.35 150.16 86.19 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.607 1.319 . . . . 0.0 110.487 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 81.4 mt -114.11 142.06 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.229 -0.919 . . . . 0.0 110.257 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 54.7 m -112.54 150.96 30.57 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.231 -0.918 . . . . 0.0 110.171 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.447 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 26.1 m-85 -116.02 162.08 27.64 Favored Pre-proline 0 N--CA 1.492 1.631 0 O-C-N 121.31 -0.869 . . . . 0.0 110.188 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.36 -12.06 22.23 Favored 'Trans proline' 0 C--N 1.31 -1.47 0 O-C-N 123.759 1.399 . . . . 0.0 110.555 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.411 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.7 p30 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.235 -0.916 . . . . 0.0 110.27 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 71.9 mtt-85 -119.23 145.31 46.16 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.236 -1.155 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 75.7 m -130.28 154.7 47.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.237 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.5 p -78.22 168.51 19.74 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.228 -0.92 . . . . 0.0 110.248 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.212 179.989 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.287 0.565 . . . . 0.0 110.239 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -69.64 162.66 65.86 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.238 -0.914 . . . . 0.0 110.252 179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.462 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.41 162.24 21.23 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.673 1.354 . . . . 0.0 110.535 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.45 150.25 85.98 Favored 'Trans proline' 0 C--N 1.311 -1.437 0 O-C-N 123.69 1.363 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.2 mt -109.55 140.24 29.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.246 -0.909 . . . . 0.0 110.201 -179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.1 m -123.11 149.11 44.92 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.223 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.476 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 21.3 m-85 -107.61 161.87 21.7 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.454 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.25 -12.0 21.62 Favored 'Trans proline' 0 C--N 1.311 -1.441 0 O-C-N 123.682 1.359 . . . . 0.0 110.584 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.476 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 54.0 p30 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.176 -0.953 . . . . 0.0 110.181 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.414 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 53.6 ttt180 -110.96 131.42 55.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.203 -1.175 . . . . 0.0 110.189 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 97.8 m -128.41 153.8 46.71 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.212 -0.93 . . . . 0.0 110.191 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 17.8 p -98.97 170.6 8.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.208 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 38.6 tttm . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.982 -1.009 . . . . 0.0 110.2 179.981 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.188 0.518 . . . . 0.0 110.235 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.461 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 1.0 OUTLIER -65.61 163.08 37.33 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.266 -0.896 . . . . 0.0 110.167 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.461 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.7 153.58 66.35 Favored 'Trans proline' 0 C--N 1.312 -1.358 0 O-C-N 123.717 1.377 . . . . 0.0 110.533 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.48 151.78 77.55 Favored 'Trans proline' 0 C--N 1.312 -1.39 0 O-C-N 123.714 1.376 . . . . 0.0 110.554 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 78.1 mt -122.15 135.79 61.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.218 -0.926 . . . . 0.0 110.243 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.0 m -111.54 153.18 26.61 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.265 -0.897 . . . . 0.0 110.264 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 37.9 m-85 -120.43 163.35 29.25 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.243 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.41 -16.43 47.23 Favored 'Trans proline' 0 C--N 1.311 -1.404 0 O-C-N 123.765 1.403 . . . . 0.0 110.62 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.414 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 54.1 p30 . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.241 -0.912 . . . . 0.0 110.135 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.409 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.416 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 72.6 mtp85 -122.27 146.57 47.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.251 -1.146 . . . . 0.0 110.231 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 93.9 m -124.37 154.64 40.06 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 110.187 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 67.8 p -80.6 165.7 21.81 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.22 -0.925 . . . . 0.0 110.2 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 21.2 mtpt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 118.039 -0.981 . . . . 0.0 110.168 -179.998 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 33.1 m . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.236 0.541 . . . . 0.0 110.258 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 4.1 pt -126.08 159.43 62.15 Favored Pre-proline 0 N--CA 1.491 1.576 0 O-C-N 121.249 -0.907 . . . . 0.0 110.235 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.407 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 2.9 Cg_endo -61.42 150.74 83.71 Favored 'Trans proline' 0 C--N 1.311 -1.415 0 O-C-N 123.682 1.359 . . . . 0.0 110.596 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 3.0 Cg_endo -61.6 150.44 85.48 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.774 1.407 . . . . 0.0 110.529 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 74.4 mt -113.28 142.82 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.925 . . . . 0.0 110.214 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 96.7 m -115.42 153.55 30.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.205 -0.935 . . . . 0.0 110.21 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.452 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 23.5 m-85 -106.98 162.05 20.94 Favored Pre-proline 0 N--CA 1.49 1.562 0 O-C-N 121.23 -0.918 . . . . 0.0 110.228 179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.452 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.46 -12.01 22.36 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.767 1.404 . . . . 0.0 110.598 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 49.7 p30 . . . . . 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.229 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.208 0 N-CA-C 109.482 -1.447 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.43 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 17.3 tpt180 -113.28 135.15 54.15 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.191 -1.182 . . . . 0.0 110.181 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 97.3 m -125.72 154.34 42.6 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.223 -0.923 . . . . 0.0 110.194 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 47.7 p -113.63 170.46 8.23 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.207 -0.933 . . . . 0.0 110.134 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 32.6 mttp . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.194 179.997 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.492 1.628 0 CA-C-O 121.214 0.531 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.2 pt -103.74 161.11 23.97 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.307 -0.87 . . . . 0.0 110.184 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.403 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -61.42 151.23 81.01 Favored 'Trans proline' 0 C--N 1.312 -1.38 0 O-C-N 123.693 1.365 . . . . 0.0 110.57 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 150.01 86.84 Favored 'Trans proline' 0 C--N 1.31 -1.457 0 O-C-N 123.692 1.364 . . . . 0.0 110.549 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 66.9 mt -120.07 136.4 57.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.279 -0.888 . . . . 0.0 110.215 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 66.4 m -115.84 147.47 40.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.285 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.472 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 17.7 m-85 -108.81 162.0 21.6 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.176 -0.953 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.472 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.3 -12.06 22.03 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.624 1.328 . . . . 0.0 110.512 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.467 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 51.9 p30 . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.284 -0.885 . . . . 0.0 110.266 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.404 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.395 -1.482 . . . . 0.0 109.395 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 64.3 mtt180 -128.7 146.39 50.89 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -1.127 . . . . 0.0 110.23 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.0 m -123.39 160.68 26.29 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.167 -0.958 . . . . 0.0 110.184 -179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.459 ' O ' ' O ' ' A' ' 5' ' ' LYS . 34.6 p -109.09 168.31 9.46 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.23 -0.919 . . . . 0.0 110.214 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.459 ' O ' ' O ' ' A' ' 4' ' ' THR . 69.1 mttm . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 118.02 -0.991 . . . . 0.0 110.253 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.438 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 11.8 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.17 0.51 . . . . 0.0 110.28 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.464 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 4.6 pt -136.54 163.88 46.68 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.189 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.38 157.52 40.41 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.674 1.355 . . . . 0.0 110.587 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.2 149.98 86.74 Favored 'Trans proline' 0 C--N 1.311 -1.425 0 O-C-N 123.689 1.363 . . . . 0.0 110.562 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 71.9 mt -121.39 144.25 31.11 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.219 -0.926 . . . . 0.0 110.204 179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 92.3 m -114.43 151.92 32.4 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.244 -0.91 . . . . 0.0 110.159 -179.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.462 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.0 m-85 -110.88 162.14 21.93 Favored Pre-proline 0 N--CA 1.49 1.566 0 O-C-N 121.227 -0.921 . . . . 0.0 110.213 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.462 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 2.9 Cg_endo -61.44 -12.02 22.33 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.723 1.381 . . . . 0.0 110.604 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.6 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 110.28 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.257 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -125.25 144.05 50.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.282 -1.129 . . . . 0.0 110.219 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 60.5 m -127.11 155.88 42.62 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.257 -0.902 . . . . 0.0 110.193 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -111.42 172.92 6.6 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.187 -0.946 . . . . 0.0 110.193 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 86.1 mttt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 118.066 -0.969 . . . . 0.0 110.18 -179.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.326 0.584 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.3 pt -62.22 152.58 78.27 Favored Pre-proline 0 N--CA 1.492 1.652 0 O-C-N 121.161 -0.962 . . . . 0.0 110.175 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 157.83 40.03 Favored 'Trans proline' 0 C--N 1.31 -1.468 0 O-C-N 123.728 1.383 . . . . 0.0 110.529 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.41 149.96 87.19 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.769 1.405 . . . . 0.0 110.592 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 65.8 mt -110.99 135.23 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.188 -0.945 . . . . 0.0 110.206 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.427 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 98.3 m -120.99 150.42 41.15 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 110.224 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.47 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.4 m-85 -116.63 161.96 29.36 Favored Pre-proline 0 N--CA 1.491 1.593 0 O-C-N 121.242 -0.911 . . . . 0.0 110.163 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.47 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.32 -12.03 21.95 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.61 1.321 . . . . 0.0 110.574 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.436 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 53.8 p30 . . . . . 0 N--CA 1.492 1.641 0 O-C-N 121.231 -0.918 . . . . 0.0 110.205 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.485 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 20.7 ttt180 -119.91 141.64 49.43 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.214 -1.168 . . . . 0.0 110.215 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 83.8 m -124.4 154.97 39.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.2 -0.938 . . . . 0.0 110.19 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.7 p -92.28 171.05 9.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.179 -0.951 . . . . 0.0 110.154 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 18.0 mttp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 117.953 -1.022 . . . . 0.0 110.21 -179.968 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.436 ' OG ' ' N ' ' A' ' 7' ' ' ILE . 8.5 t . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.304 0.573 . . . . 0.0 110.254 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.436 ' N ' ' OG ' ' A' ' 6' ' ' SER . 1.9 pt -56.75 153.36 22.39 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.239 -0.913 . . . . 0.0 110.192 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.6 150.43 85.54 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.722 1.38 . . . . 0.0 110.503 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.62 151.28 81.31 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.714 1.376 . . . . 0.0 110.514 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 67.9 mt -112.05 140.91 29.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.213 -0.929 . . . . 0.0 110.15 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 50.3 m -114.02 153.0 30.13 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.303 -0.873 . . . . 0.0 110.227 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.458 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 22.2 m-85 -116.99 161.93 30.11 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.297 -0.877 . . . . 0.0 110.181 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.57 -12.11 23.16 Favored 'Trans proline' 0 C--N 1.311 -1.424 0 O-C-N 123.64 1.337 . . . . 0.0 110.481 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 52.6 p30 . . . . . 0 N--CA 1.49 1.565 0 O-C-N 121.176 -0.952 . . . . 0.0 110.243 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.275 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -120.4 140.23 51.64 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.252 -1.146 . . . . 0.0 110.24 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 63.1 m -124.07 170.96 10.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.328 -0.857 . . . . 0.0 110.147 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.4 p -116.77 160.28 21.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.275 -0.891 . . . . 0.0 110.28 179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 14.1 ttpt . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 117.955 -1.021 . . . . 0.0 110.2 -179.999 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 58.2 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.232 0.539 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.428 ' HB ' ' HD2' ' A' ' 8' ' ' PRO . 3.1 pt -107.14 162.22 20.4 Favored Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.213 -0.93 . . . . 0.0 110.192 -179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD2' ' HB ' ' A' ' 7' ' ' ILE . 3.1 Cg_exo -61.59 150.32 85.95 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.682 1.359 . . . . 0.0 110.463 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.77 152.07 76.7 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.714 1.376 . . . . 0.0 110.561 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 57.5 mt -125.64 130.86 72.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.287 -0.883 . . . . 0.0 110.193 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.7 m -101.91 158.48 16.1 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.259 -0.901 . . . . 0.0 110.222 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.467 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.8 m-85 -115.48 161.87 27.81 Favored Pre-proline 0 N--CA 1.49 1.558 0 O-C-N 121.236 -0.915 . . . . 0.0 110.232 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.467 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.27 -12.17 22.42 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.659 1.347 . . . . 0.0 110.542 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 52.1 p30 . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.214 -0.929 . . . . 0.0 110.192 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.289 0 N-CA-C 109.485 -1.446 . . . . 0.0 109.485 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.418 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 99.4 mtt180 -121.3 144.57 48.56 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.215 -1.168 . . . . 0.0 110.187 179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 64.3 m -120.96 162.35 20.04 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.293 -0.879 . . . . 0.0 110.221 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 29.5 p -106.75 172.44 6.82 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.279 -0.888 . . . . 0.0 110.243 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.467 ' HG2' ' OXT' ' A' ' 5' ' ' LYS . 23.5 tttp . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.181 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.253 0.549 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pt -65.48 157.05 80.19 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.248 -0.907 . . . . 0.0 110.249 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.61 149.83 88.1 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.658 1.346 . . . . 0.0 110.578 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.79 150.24 86.73 Favored 'Trans proline' 0 C--N 1.311 -1.42 0 O-C-N 123.666 1.351 . . . . 0.0 110.602 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 75.4 mt -120.86 140.1 46.05 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.21 -0.931 . . . . 0.0 110.157 -179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.438 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 94.0 m -110.92 155.38 22.74 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.229 -0.919 . . . . 0.0 110.206 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.465 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 25.4 m-85 -114.09 161.94 25.52 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.213 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.465 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.38 -11.97 21.9 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 O-C-N 123.757 1.398 . . . . 0.0 110.536 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 56.1 p30 . . . . . 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 110.23 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.251 0 N-CA-C 109.459 -1.457 . . . . 0.0 109.459 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 84.1 mmt-85 -123.99 145.32 49.26 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.214 -1.168 . . . . 0.0 110.178 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 87.3 m -130.67 153.89 48.48 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.192 -0.943 . . . . 0.0 110.141 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 30.1 p -103.1 174.19 5.98 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.23 -0.918 . . . . 0.0 110.267 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 9' ' ' PRO . 46.3 tttp . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.197 -179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.308 0.575 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 1.1 pt -64.07 151.94 88.87 Favored Pre-proline 0 N--CA 1.492 1.637 0 O-C-N 121.22 -0.925 . . . . 0.0 110.225 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ILE . 3.0 Cg_endo -62.11 160.7 29.19 Favored 'Trans proline' 0 C--N 1.31 -1.477 0 O-C-N 123.746 1.393 . . . . 0.0 110.529 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.445 ' HB3' ' HB3' ' A' ' 5' ' ' LYS . 2.9 Cg_endo -61.29 150.87 82.8 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 O-C-N 123.759 1.4 . . . . 0.0 110.529 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 69.0 mt -112.42 143.21 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.28 -0.887 . . . . 0.0 110.205 -179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.5 m -121.03 150.24 41.46 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.296 -0.877 . . . . 0.0 110.117 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.455 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 18.3 m-85 -113.31 161.46 26.99 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.219 -0.926 . . . . 0.0 110.258 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.455 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.49 -12.22 23.35 Favored 'Trans proline' 0 C--N 1.31 -1.455 0 O-C-N 123.657 1.346 . . . . 0.0 110.536 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 12' ' ' PHE . 55.1 p30 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.22 -0.925 . . . . 0.0 110.184 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.506 -1.438 . . . . 0.0 109.506 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -120.51 144.97 47.74 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.198 -1.178 . . . . 0.0 110.238 -179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 63.7 m -130.28 160.49 33.75 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.367 -0.833 . . . . 0.0 110.186 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.423 ' HG1' ' H ' ' A' ' 10' ' ' ILE . 0.8 OUTLIER -66.12 -29.62 69.96 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.318 -0.864 . . . . 0.0 110.228 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' ' O ' ' A' ' 4' ' ' THR . 63.1 mttm . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.217 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 37.9 m . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.249 0.547 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.1 pp -68.58 160.11 78.29 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.923 . . . . 0.0 110.17 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.44 153.56 65.27 Favored 'Trans proline' 0 C--N 1.312 -1.356 0 O-C-N 123.691 1.364 . . . . 0.0 110.476 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -61.34 154.68 56.88 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.751 1.395 . . . . 0.0 110.428 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 68.6 mt -112.38 138.49 41.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.21 -0.931 . . . . 0.0 110.214 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.404 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 56.9 m -121.4 149.99 42.18 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.303 -0.873 . . . . 0.0 110.129 179.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.433 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 35.7 m-85 -111.31 164.33 15.25 Favored Pre-proline 0 N--CA 1.492 1.646 0 O-C-N 121.191 -0.943 . . . . 0.0 110.22 -179.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_exo -61.47 -12.41 24.15 Favored 'Trans proline' 0 C--N 1.31 -1.46 0 O-C-N 123.718 1.378 . . . . 0.0 110.549 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 53.0 p30 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.369 -0.832 . . . . 0.0 110.181 -179.985 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.466 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 32.2 mtp180 -113.05 146.28 39.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.297 -1.119 . . . . 0.0 110.244 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 86.4 m -133.39 157.75 44.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.23 -0.919 . . . . 0.0 110.224 -179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 50.9 p -111.63 174.97 5.62 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.239 -0.913 . . . . 0.0 110.25 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 19.1 mttt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.15 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.237 0.541 . . . . 0.0 110.265 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -52.31 149.93 9.37 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.201 -0.937 . . . . 0.0 110.183 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -62.25 149.25 91.34 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.655 1.345 . . . . 0.0 110.529 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' O ' HD13 ' A' ' 10' ' ' ILE . 3.0 Cg_endo -62.29 158.57 39.46 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.615 1.324 . . . . 0.0 110.544 179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 25.8 mm -113.99 126.22 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -0.906 . . . . 0.0 110.181 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 59.0 m -116.28 150.81 37.0 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -119.81 165.21 18.39 Favored Pre-proline 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.18 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -61.33 -14.74 36.19 Favored 'Trans proline' 0 C--N 1.311 -1.439 0 O-C-N 123.67 1.353 . . . . 0.0 110.468 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD1' ' N ' ' A' ' 2' ' ' ARG . 47.6 p30 . . . . . 0 N--CA 1.49 1.571 0 O-C-N 121.214 -0.929 . . . . 0.0 110.227 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.29 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -121.58 137.96 54.52 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -1.148 . . . . 0.0 110.227 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 10' ' ' ILE . 78.0 m -127.66 158.67 36.95 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.191 -0.943 . . . . 0.0 110.233 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 10' ' ' ILE . 19.8 p -79.68 163.15 24.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.302 -0.874 . . . . 0.0 110.278 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 85.1 mttt . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.249 -179.991 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.269 0.557 . . . . 0.0 110.184 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.768 HG23 ' HD2' ' A' ' 8' ' ' PRO . 2.3 mp -57.52 146.19 65.53 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.251 -0.906 . . . . 0.0 110.118 179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.768 ' HD2' HG23 ' A' ' 7' ' ' ILE . 2.9 Cg_endo -61.55 154.17 61.48 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 O-C-N 123.586 1.308 . . . . 0.0 110.572 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.44 152.54 72.25 Favored 'Trans proline' 0 C--N 1.311 -1.412 0 O-C-N 123.721 1.38 . . . . 0.0 110.563 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.493 ' O ' ' HA ' ' A' ' 3' ' ' CYS . 70.6 mt -108.91 135.88 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.285 -0.884 . . . . 0.0 110.216 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.2 m -113.24 154.25 27.07 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -121.39 163.83 28.01 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.229 -0.919 . . . . 0.0 110.288 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -61.35 -13.57 29.62 Favored 'Trans proline' 0 C--N 1.311 -1.444 0 O-C-N 123.69 1.363 . . . . 0.0 110.585 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.401 ' C ' ' OD1' ' A' ' 14' ' ' ASP . 53.9 p30 . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 110.196 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.424 ' N ' ' OD1' ' A' ' 14' ' ' ASP . . . . . . . . 0 N--CA 1.49 2.279 0 N-CA-C 109.451 -1.46 . . . . 0.0 109.451 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 68.5 mtt180 -132.18 141.04 48.95 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.269 -1.136 . . . . 0.0 110.251 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 86.0 m -118.8 167.3 11.82 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.259 -0.9 . . . . 0.0 110.164 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.532 ' CG2' ' HB ' ' A' ' 10' ' ' ILE . 30.2 p -80.48 162.63 24.28 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.253 -0.905 . . . . 0.0 110.185 179.971 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 27.1 tttt . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.175 -179.972 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 121.22 0.533 . . . . 0.0 110.212 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.758 HG23 ' HD2' ' A' ' 8' ' ' PRO . 12.4 mt -74.43 146.21 83.57 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.241 -0.912 . . . . 0.0 110.141 -179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.758 ' HD2' HG23 ' A' ' 7' ' ' ILE . 3.0 Cg_exo -61.56 162.13 22.1 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.618 1.325 . . . . 0.0 110.499 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -61.47 158.46 36.21 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 O-C-N 123.686 1.361 . . . . 0.0 110.51 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.532 ' HB ' ' CG2' ' A' ' 4' ' ' THR . 68.8 mt -125.05 128.77 73.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.173 -0.954 . . . . 0.0 110.2 179.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HA ' ' HA ' ' A' ' 3' ' ' CYS . 36.1 m -115.01 150.14 36.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.254 -0.904 . . . . 0.0 110.222 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.445 ' HB3' ' HD2' ' A' ' 13' ' ' PRO . 24.5 m-85 -121.3 161.49 40.75 Favored Pre-proline 0 N--CA 1.491 1.611 0 O-C-N 121.217 -0.927 . . . . 0.0 110.202 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.445 ' HD2' ' HB3' ' A' ' 12' ' ' PHE . 3.0 Cg_endo -61.35 -12.92 25.99 Favored 'Trans proline' 0 C--N 1.311 -1.427 0 O-C-N 123.703 1.37 . . . . 0.0 110.591 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 1' ' ' GLY . 52.1 p30 . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.265 -0.897 . . . . 0.0 110.159 179.98 . . . . . . . . 1 1 . 1 stop_ save_