data_2m6e_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 2m6e _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.827 0.346 . . . . 74.239999999999995 110.933 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.540000000000006 111.1 179.963 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.54 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 121.664 0.745 . . . . 64.040000000000006 110.965 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.450000000000003 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.340000000000003 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 72.329999999999998 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 1.454 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.879 0.371 . . . . 71.540000000000006 110.875 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 63.200000000000003 111.126 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.688 0.756 . . . . 73.530000000000001 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.209999999999994 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.319999999999993 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 1.454 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.430000000000007 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 1.467 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.832 0.349 . . . . 71.019999999999996 110.942 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.120000000000005 111.124 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.698 0.761 . . . . 74.150000000000006 110.962 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 72.409999999999997 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.230000000000004 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 1.467 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 75.209999999999994 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.834 0.35 . . . . 64.519999999999996 110.909 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.400000000000006 111.141 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.704 0.764 . . . . 74.349999999999994 110.914 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.519999999999996 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.239999999999995 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.319999999999993 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 1.466 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.104 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.679 0.752 . . . . 65.209999999999994 110.919 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 71.040000000000006 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 73.209999999999994 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 1.466 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.209999999999994 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.866 0.365 . . . . 74.239999999999995 110.867 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.123 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 121.689 0.757 . . . . 75.329999999999998 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 72.140000000000001 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.200000000000003 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.89 0.376 . . . . 75.099999999999994 110.868 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.120000000000005 111.084 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.721 0.772 . . . . 71.230000000000004 110.936 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 73.510000000000005 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 75.439999999999998 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 1.446 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.867 0.365 . . . . 70.239999999999995 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 111.104 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.522 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 121.71 0.767 . . . . 65.239999999999995 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 74.439999999999998 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 1.446 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 71.549999999999997 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.861 0.363 . . . . 74.409999999999997 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 111.15 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.521 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.649 0.738 . . . . 72.340000000000003 110.934 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.521 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.150000000000006 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.549999999999997 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.010000000000005 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.88 0.372 . . . . 73.400000000000006 110.869 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 75.299999999999997 111.112 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.522 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.664 0.745 . . . . 72.430000000000007 110.929 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.439999999999998 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.150000000000006 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.129999999999995 110.893 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.495 -0.242 . . . . 61.219999999999999 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p -79.85 138.45 37.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.827 0.346 . . . . 74.239999999999995 110.933 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.540000000000006 111.1 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.54 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.9 137.95 2.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.019 -0.991 . . . . 64.040000000000006 110.965 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.54 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.450000000000003 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.340000000000003 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 72.329999999999998 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.467 -0.253 . . . . 74.230000000000004 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 1.454 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p -79.96 138.69 37.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.879 0.371 . . . . 71.540000000000006 110.875 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -51.62 103.21 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 63.200000000000003 111.126 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.85 137.97 2.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.059 -0.973 . . . . 73.530000000000001 110.931 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.209999999999994 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.319999999999993 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 1.454 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.430000000000007 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.447 -0.261 . . . . 60.310000000000002 112.447 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 1.467 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.9 138.6 37.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.832 0.349 . . . . 71.019999999999996 110.942 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t -51.53 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.120000000000005 111.124 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.88 137.98 2.41 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 114.989 -1.005 . . . . 74.150000000000006 110.962 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 72.409999999999997 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.230000000000004 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 1.467 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 75.209999999999994 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.5 -0.24 . . . . 72.420000000000002 112.5 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p -79.93 138.62 37.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.834 0.35 . . . . 64.519999999999996 110.909 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t -51.54 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.400000000000006 111.141 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.9 138.01 2.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.045 -0.98 . . . . 74.349999999999994 110.914 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.519999999999996 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.239999999999995 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.319999999999993 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.484 -0.246 . . . . 61.329999999999998 112.484 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 1.466 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.93 138.78 37.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -51.65 103.26 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 74.140000000000001 111.104 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.92 137.95 2.44 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 114.987 -1.006 . . . . 65.209999999999994 110.919 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 71.040000000000006 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 73.209999999999994 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 1.466 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.209999999999994 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.467 -0.253 . . . . 41.130000000000003 112.467 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.92 138.51 37.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 74.239999999999995 110.867 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 64.530000000000001 111.123 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.539 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.85 137.96 2.4 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.017 -0.992 . . . . 75.329999999999998 110.91 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.539 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 72.140000000000001 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.200000000000003 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.483 -0.247 . . . . 55.549999999999997 112.483 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -79.96 138.92 37.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.89 0.376 . . . . 75.099999999999994 110.868 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t -51.7 103.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.120000000000005 111.084 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.538 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.86 137.94 2.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.002 -0.999 . . . . 71.230000000000004 110.936 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.538 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 73.510000000000005 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 75.439999999999998 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.463 -0.255 . . . . 62.399999999999999 112.463 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 1.446 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p -79.93 138.44 37.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 70.239999999999995 110.881 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -51.73 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 111.104 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.522 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.11 137.86 2.02 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.023 -0.99 . . . . 65.239999999999995 110.889 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 74.439999999999998 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 1.446 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 71.549999999999997 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.481 -0.248 . . . . 73.040000000000006 112.481 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p -79.91 138.38 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 74.409999999999997 110.917 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t -51.6 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 74.209999999999994 111.15 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.521 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.15 137.84 2.05 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.002 -0.999 . . . . 72.340000000000003 110.934 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.521 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.150000000000006 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.549999999999997 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.010000000000005 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.508 -0.237 . . . . 64.329999999999998 112.508 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p -79.97 138.43 37.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.88 0.372 . . . . 73.400000000000006 110.869 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -51.69 103.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 75.299999999999997 111.112 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.522 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 -42.15 137.83 2.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 114.992 -1.004 . . . . 72.430000000000007 110.929 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.522 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.439999999999998 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.150000000000006 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 73.129999999999995 110.893 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.827 0.346 . . . . 74.24 110.933 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.54 111.1 179.963 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 121.664 0.745 . . . . 64.04 110.965 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.45 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 52.51 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.879 0.371 . . . . 71.54 110.875 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 55.13 111.126 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.688 0.756 . . . . 70.22 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.21 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.14 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.43 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.832 0.349 . . . . 64.0 110.942 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.12 111.124 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.698 0.761 . . . . 71.13 110.962 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 71.41 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 61.31 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.834 0.35 . . . . 64.11 110.909 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.4 111.141 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.704 0.764 . . . . 65.25 110.914 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.52 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.13 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.32 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.54 111.104 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.679 0.752 . . . . 65.21 110.919 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 63.33 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 70.22 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.21 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.866 0.365 . . . . 74.24 110.867 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 63.05 111.123 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 121.689 0.757 . . . . 75.33 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 71.12 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.1 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.2 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.89 0.376 . . . . 75.1 110.868 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.12 111.084 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.721 0.772 . . . . 61.34 110.936 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 72.03 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.867 0.365 . . . . 70.24 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.2 111.104 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 121.71 0.767 . . . . 65.24 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 73.45 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.03 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 63.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.861 0.363 . . . . 74.41 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.22 111.15 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.649 0.738 . . . . 72.34 110.934 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.15 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.55 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.01 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.88 0.372 . . . . 73.4 110.869 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 53.04 111.112 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.534 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.664 0.745 . . . . 72.43 110.929 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.44 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.15 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 72.03 110.893 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.495 -0.242 . . . . 61.22 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p -79.85 138.45 37.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.827 0.346 . . . . 74.24 110.933 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.54 111.1 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.9 137.95 2.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.019 -0.991 . . . . 64.04 110.965 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.45 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.15 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 52.51 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.467 -0.253 . . . . 74.23 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p -79.96 138.69 37.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.879 0.371 . . . . 71.54 110.875 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -51.62 103.21 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 55.13 111.126 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.85 137.97 2.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.059 -0.973 . . . . 70.22 110.931 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.21 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.14 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.43 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.447 -0.261 . . . . 24.5 112.447 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.9 138.6 37.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.832 0.349 . . . . 64.0 110.942 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t -51.53 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.12 111.124 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.88 137.98 2.41 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 114.989 -1.005 . . . . 71.13 110.962 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 71.41 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.23 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 61.31 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.5 -0.24 . . . . 70.51 112.5 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p -79.93 138.62 37.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.834 0.35 . . . . 64.11 110.909 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t -51.54 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.4 111.141 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.9 138.01 2.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.045 -0.98 . . . . 65.25 110.914 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.52 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.13 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.32 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.484 -0.246 . . . . 61.32 112.484 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.93 138.78 37.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -51.65 103.26 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.54 111.104 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.92 137.95 2.44 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 114.987 -1.006 . . . . 65.21 110.919 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 63.33 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 70.22 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.21 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.467 -0.253 . . . . 41.13 112.467 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.92 138.51 37.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 74.24 110.867 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 63.05 111.123 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.85 137.96 2.4 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.017 -0.992 . . . . 75.33 110.91 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 71.12 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.1 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.2 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.483 -0.247 . . . . 55.55 112.483 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -79.96 138.92 37.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.89 0.376 . . . . 75.1 110.868 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t -51.7 103.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.12 111.084 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.86 137.94 2.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.002 -0.999 . . . . 61.34 110.936 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 72.03 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.32 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.31 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.463 -0.255 . . . . 62.23 112.463 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p -79.93 138.44 37.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 70.24 110.881 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -51.73 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.2 111.104 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.11 137.86 2.02 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.023 -0.99 . . . . 65.24 110.889 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 73.45 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.03 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 63.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.481 -0.248 . . . . 73.04 112.481 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p -79.91 138.38 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 74.41 110.917 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t -51.6 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.22 111.15 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.15 137.84 2.05 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.002 -0.999 . . . . 72.34 110.934 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.15 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.55 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.01 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.508 -0.237 . . . . 54.02 112.508 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p -79.97 138.43 37.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.88 0.372 . . . . 73.4 110.869 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -51.69 103.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 53.04 111.112 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.534 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 -42.15 137.83 2.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 114.992 -1.004 . . . . 72.43 110.929 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.44 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.15 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 72.03 110.893 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.827 0.346 . . . . 74.239999999999995 110.933 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.540000000000006 111.1 179.963 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.137 0 CA-C-O 121.664 0.745 . . . . 64.040000000000006 110.965 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.450000000000003 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.150000000000006 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 52.509999999999998 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.879 0.371 . . . . 71.540000000000006 110.875 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 55.130000000000003 111.126 179.929 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.688 0.756 . . . . 70.219999999999999 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.209999999999994 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.140000000000001 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.430000000000007 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.232 0.145 0 CA-C-O 120.832 0.349 . . . . 64.0 110.942 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.120000000000005 111.124 179.912 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 . . . . . 0 C--O 1.232 0.136 0 CA-C-O 121.698 0.761 . . . . 71.129999999999995 110.962 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 71.409999999999997 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.230000000000004 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 61.310000000000002 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.834 0.35 . . . . 64.109999999999999 110.909 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.400000000000006 111.141 179.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.082 0 CA-C-O 121.704 0.764 . . . . 65.25 110.914 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.519999999999996 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.129999999999995 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.319999999999993 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.104 179.92 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 . . . . . 0 C--O 1.231 0.107 0 CA-C-O 121.679 0.752 . . . . 65.209999999999994 110.919 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 63.329999999999998 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 70.219999999999999 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.209999999999994 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.866 0.365 . . . . 74.239999999999995 110.867 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 63.049999999999997 111.123 179.908 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 121.689 0.757 . . . . 75.329999999999998 110.91 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 71.120000000000005 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.200000000000003 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.89 0.376 . . . . 75.099999999999994 110.868 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.120000000000005 111.084 179.943 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 . . . . . 0 C--O 1.231 0.13 0 CA-C-O 121.721 0.772 . . . . 61.340000000000003 110.936 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 72.030000000000001 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.310000000000002 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.867 0.365 . . . . 70.239999999999995 110.881 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 111.104 179.953 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 121.71 0.767 . . . . 65.239999999999995 110.889 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 73.450000000000003 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 63.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.861 0.363 . . . . 74.409999999999997 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 111.15 179.902 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 . . . . . 0 C--O 1.231 0.118 0 CA-C-O 121.649 0.738 . . . . 72.340000000000003 110.934 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.150000000000006 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.549999999999997 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.010000000000005 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.88 0.372 . . . . 73.400000000000006 110.869 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 53.039999999999999 111.112 179.949 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.534 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 121.664 0.745 . . . . 72.430000000000007 110.929 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.439999999999998 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.150000000000006 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 72.030000000000001 110.893 -179.938 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.495 -0.242 . . . . 61.219999999999999 112.495 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.7 p -79.85 138.45 37.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.827 0.346 . . . . 74.239999999999995 110.933 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 57.3 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 75.540000000000006 111.1 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.9 137.95 2.43 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.019 -0.991 . . . . 64.040000000000006 110.965 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.4 Cg_endo -69.84 -25.59 7.96 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.644 -1.815 . . . . 63.450000000000003 112.339 0.021 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.96 75.01 6.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.199 -0.455 . . . . 75.150000000000006 110.885 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.237 -0.438 . . . . 52.509999999999998 110.871 179.996 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.305 0 N-CA-C 112.467 -0.253 . . . . 74.230000000000004 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.1 p -79.96 138.69 37.14 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.879 0.371 . . . . 71.540000000000006 110.875 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 60.5 t -51.62 103.21 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.481 . . . . 55.130000000000003 111.126 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.85 137.97 2.4 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 115.059 -0.973 . . . . 70.219999999999999 110.931 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.708 -1.788 . . . . 72.209999999999994 112.365 -0.06 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.97 74.9 6.72 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.236 -0.438 . . . . 74.140000000000001 110.916 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 1.425 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.7 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.222 -0.445 . . . . 73.430000000000007 110.846 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.447 -0.261 . . . . 24.5 112.447 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.9 138.6 37.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.832 0.349 . . . . 64.0 110.942 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 62.6 t -51.53 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.45 . . . . 72.120000000000005 111.124 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.3 t80 -42.88 137.98 2.41 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 114.989 -1.005 . . . . 71.129999999999995 110.962 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.7 Cg_endo -69.75 -25.63 7.89 Favored 'Cis proline' 0 C--O 1.232 0.176 0 C-N-CA 122.633 -1.82 . . . . 71.409999999999997 112.353 -0.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.93 74.95 6.66 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.267 -0.424 . . . . 74.230000000000004 110.939 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 1.427 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.346 0 CA-C-N 116.248 -0.433 . . . . 61.310000000000002 110.878 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.5 -0.24 . . . . 70.510000000000005 112.5 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.5 p -79.93 138.62 37.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.834 0.35 . . . . 64.109999999999999 110.909 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 82.6 t -51.54 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.400000000000006 111.141 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.9 138.01 2.42 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 115.045 -0.98 . . . . 65.25 110.914 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.75 -25.67 7.87 Favored 'Cis proline' 0 C--N 1.341 0.161 0 C-N-CA 122.711 -1.787 . . . . 73.519999999999996 112.347 -0.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.92 6.63 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.2 -0.455 . . . . 74.129999999999995 110.909 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.273 -0.421 . . . . 72.319999999999993 110.916 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.484 -0.246 . . . . 61.32 112.484 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 29.5 p -79.93 138.78 37.19 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.909 0.385 . . . . 61.32 110.897 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 73.4 t -51.65 103.26 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.184 -0.462 . . . . 72.540000000000006 111.104 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.549 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.2 t80 -42.92 137.95 2.44 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-N 114.987 -1.006 . . . . 65.209999999999994 110.919 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.549 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.8 Cg_endo -69.74 -25.68 7.86 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.718 -1.784 . . . . 63.329999999999998 112.36 -0.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.9 m95 -79.95 74.96 6.69 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.218 -0.446 . . . . 70.219999999999999 110.927 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 1.426 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.259 -0.428 . . . . 71.209999999999994 110.904 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.287 0 N-CA-C 112.467 -0.253 . . . . 41.130000000000003 112.467 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.6 p -79.92 138.51 37.14 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.866 0.365 . . . . 74.239999999999995 110.867 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 59.9 t -51.67 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.171 -0.468 . . . . 63.049999999999997 111.123 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.552 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.85 137.96 2.4 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.017 -0.992 . . . . 75.329999999999998 110.91 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.1 Cg_endo -69.72 -25.7 7.83 Favored 'Cis proline' 0 C--N 1.342 0.191 0 C-N-CA 122.65 -1.812 . . . . 71.120000000000005 112.364 -0.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.9 74.93 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.206 -0.452 . . . . 74.099999999999994 110.899 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.282 -0.417 . . . . 74.200000000000003 110.885 -179.977 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.483 -0.247 . . . . 55.549999999999997 112.483 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -79.96 138.92 37.19 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.89 0.376 . . . . 75.099999999999994 110.868 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 43.5 t -51.7 103.23 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.159 -0.473 . . . . 72.120000000000005 111.084 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.55 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 12.4 t80 -42.86 137.94 2.41 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 115.002 -0.999 . . . . 61.340000000000003 110.936 -179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.55 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.74 -25.74 7.82 Favored 'Cis proline' 0 C--N 1.342 0.189 0 C-N-CA 122.661 -1.808 . . . . 72.030000000000001 112.348 -0.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 12.8 m95 -79.91 74.98 6.63 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.227 -0.442 . . . . 73.319999999999993 110.933 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 72.310000000000002 110.899 179.978 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.294 0 N-CA-C 112.463 -0.255 . . . . 62.229999999999997 112.463 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 8' ' ' CYS . 30.3 p -79.93 138.44 37.11 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.867 0.365 . . . . 70.239999999999995 110.881 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 48.4 t -51.73 103.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.171 -0.468 . . . . 74.200000000000003 111.104 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.11 137.86 2.02 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 115.023 -0.99 . . . . 65.239999999999995 110.889 -179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 54.3 Cg_endo -69.7 -25.29 8.08 Favored 'Cis proline' 0 C--O 1.231 0.159 0 C-N-CA 122.716 -1.785 . . . . 73.450000000000003 112.334 -0.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -79.94 80.71 6.31 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.241 -0.436 . . . . 75.030000000000001 110.881 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 1.412 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 1.8 m . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.266 -0.425 . . . . 63.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.481 -0.248 . . . . 73.040000000000006 112.481 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 30.1 p -79.91 138.38 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.861 0.363 . . . . 74.409999999999997 110.917 -179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 49.7 t -51.6 103.18 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.199 -0.455 . . . . 72.219999999999999 111.15 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.533 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.2 t80 -42.15 137.84 2.05 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 115.002 -0.999 . . . . 72.340000000000003 110.934 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.533 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.6 Cg_endo -69.77 -25.25 8.13 Favored 'Cis proline' 0 C--O 1.231 0.152 0 C-N-CA 122.636 -1.818 . . . . 75.150000000000006 112.327 -0.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.0 80.7 6.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.216 -0.447 . . . . 75.549999999999997 110.923 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.206 -0.452 . . . . 64.010000000000005 110.887 -179.967 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.364 0 N-CA-C 112.508 -0.237 . . . . 54.020000000000003 112.508 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 27.2 p -79.97 138.43 37.07 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.88 0.372 . . . . 73.400000000000006 110.869 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 58.4 t -51.69 103.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.167 -0.469 . . . . 53.039999999999999 111.112 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' DLE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.534 ' HA ' ' C ' ' A' ' 6' ' ' PRO . 13.4 t80 -42.15 137.83 2.05 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 114.992 -1.004 . . . . 72.430000000000007 110.929 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.534 ' C ' ' HA ' ' A' ' 5' ' ' TYR . 53.2 Cg_endo -69.79 -25.27 8.13 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.704 -1.79 . . . . 74.439999999999998 112.3 -0.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -80.02 80.62 6.41 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.248 -0.433 . . . . 65.150000000000006 110.959 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.249 -0.432 . . . . 72.030000000000001 110.893 -179.938 . . . . . . . . 0 0 . 1 stop_ save_