data_6bet_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 6bet _Structure_validation_residue.Date_analyzed 2017-12-22 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 ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.445 -0.709 0 CA-C-O 122.267 1.032 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 120.817 0.342 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo . . . . . 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 116.913 -1.518 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo . . . . . 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 122.518 1.151 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 122.272 1.034 . . . . 0.0 109.102 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo . . . . . 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 122.331 1.062 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 122.736 1.255 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.444 -0.763 0 CA-C-O 117.414 -1.279 . . . . 0.0 114.392 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 124.283 1.992 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 118.92 -0.562 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo . . . . . 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t . . . . . 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t . . . . . 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t . . . . . 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t . . . . . 0 C--O 1.219 -0.531 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo . . . . . 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 116.354 -1.784 . . . . 0.0 114.277 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.4 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 123.482 1.61 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo . . . . . 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo . . . . . 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.445 -0.71 0 CA-C-O 117.479 -1.248 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 117.199 -1.381 . . . . 0.0 112.858 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo . . . . . 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 123.124 1.44 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.222 -0.35 0 CA-C-O 118.204 -0.903 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo . . . . . 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 7.0 t . . . . . 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo . . . . . 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.443 -0.808 0 CA-C-O 125.037 2.351 . . . . 0.0 105.415 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 42.6 t . . . . . 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 . . . . . 0 N--CA 1.45 -0.443 1 CA-C-O 110.606 -4.521 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t -144.39 144.89 31.64 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 113.536 -1.665 . . . . 0.0 113.217 164.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.89 162.81 38.46 Favored 'Trans proline' 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -73.79 97.6 2.77 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 125.319 1.637 . . . . 0.0 112.887 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.31 156.86 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 127.815 3.197 . . . . 0.0 113.038 -167.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m -103.75 141.8 35.46 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t -128.35 -173.93 3.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.728 168.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -78.03 153.26 28.64 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -76.82 104.35 7.27 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 117.082 -3.511 . . . . 0.0 108.845 -174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m -131.45 155.02 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 119.574 -1.954 . . . . 0.0 114.215 -176.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m -93.1 150.36 20.57 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.512 -0.501 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t -143.51 134.4 25.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_exo -67.17 152.11 80.25 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.24 101.31 4.61 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.822 2.049 . . . . 0.0 108.808 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m -153.41 152.22 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 C-N-CA 128.47 2.708 . . . . 0.0 108.908 -163.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m -97.58 156.39 16.54 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-O 116.02 -1.943 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t -147.32 135.46 21.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.886 -2.87 . . . . 0.0 109.102 -168.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -64.8 154.88 70.5 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -85.02 84.38 7.74 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 128.188 2.595 . . . . 0.0 112.505 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -136.05 159.18 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 120.328 -1.483 . . . . 0.0 112.94 -166.121 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -86.59 148.24 25.57 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t -150.43 147.58 27.72 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 118.439 -2.663 . . . . 0.0 113.145 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.13 172.38 4.15 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -164.23 142.79 7.28 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 126.468 2.355 . . . . 0.0 105.662 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m -60.4 155.51 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.56 1.544 . . . . 0.0 108.057 -167.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t -161.41 139.37 9.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.237 0.432 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t -141.02 137.32 32.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 125.515 1.526 . . . . 0.0 114.392 -175.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.92 156.84 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -158.76 135.18 9.29 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 169.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m -76.76 134.61 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 126.497 2.373 . . . . 0.0 106.779 172.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t -147.75 138.85 23.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.1 127.5 9.96 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -78.06 162.99 28.57 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -67.01 104.39 1.38 Allowed 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.19 0.904 . . . . 0.0 110.031 -171.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m -126.01 147.53 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 127.191 2.197 . . . . 0.0 113.002 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t -129.02 157.04 42.82 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 122.988 1.375 . . . . 0.0 108.414 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t -148.36 148.49 30.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 118.658 -2.526 . . . . 0.0 112.485 -172.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -72.05 153.53 57.55 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -151.62 141.69 22.17 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.167 1.787 . . . . 0.0 112.266 167.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m -100.92 159.52 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 126.646 1.978 . . . . 0.0 115.255 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t -156.63 121.35 4.54 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m80 . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 113.198 -3.286 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -138.23 143.39 40.11 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 163.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo -62.02 145.61 96.6 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -84.81 117.46 23.87 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 124.538 2.114 . . . . 0.0 109.424 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -133.26 140.06 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 -164.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t -132.1 166.1 22.55 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t -170.79 144.54 2.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 -167.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -68.29 123.3 10.41 Favored 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -130.81 14.95 5.33 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 170.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m -58.61 134.16 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 -166.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.526 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t -142.8 149.48 38.69 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.7 t60 . . . . . 0 N--CA 1.447 -0.609 0 CA-C-O 116.146 -1.883 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.24 108.56 3.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 -166.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -75.31 157.62 41.37 Favored 'Trans proline' 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.78 112.35 3.2 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 127.016 3.293 . . . . 0.0 108.897 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t -129.86 147.84 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 130.043 3.337 . . . . 0.0 116.023 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t -131.89 132.66 43.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 63.6 t60 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t -148.43 141.04 24.45 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 125.168 1.387 . . . . 0.0 113.075 -175.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -66.96 157.35 62.05 Favored 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.03 97.19 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 124.896 1.372 . . . . 0.0 113.374 168.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m -141.1 154.2 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 130.354 3.462 . . . . 0.0 114.277 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -138.18 167.27 22.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.4 t -144.33 154.64 43.24 Favored 'General case' 0 N--CA 1.453 -0.301 1 O-C-N 115.279 -4.638 . . . . 0.0 110.563 -172.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 144.43 54.32 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.258 33.7 tt0 -64.75 126.9 29.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 115.332 -2.547 . . . . 0.0 107.22 174.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.2 157.25 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t -142.18 131.25 23.21 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.5 t60 . . . . . 0 CA--C 1.51 -0.566 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t -127.03 145.06 50.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.746 2.018 . . . . 0.0 110.52 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -72.05 127.95 13.41 Favored 'Trans proline' 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -55.09 96.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.94 1.829 . . . . 0.0 111.197 178.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m -134.21 157.11 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 124.763 1.225 . . . . 0.0 107.96 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t -150.0 150.79 32.31 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 t60 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 118.18 -0.915 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t -157.2 139.41 14.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -75.81 152.27 36.9 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -58.72 110.72 1.06 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.175 1.39 . . . . 0.0 113.43 174.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.47 154.36 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 127.548 2.339 . . . . 0.0 112.076 -172.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t -135.89 133.5 37.77 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.2 t60 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 114.117 -2.849 . . . . 0.0 112.845 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t -156.76 130.72 8.37 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.462 1.101 . . . . 0.0 108.438 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -59.66 139.03 86.91 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -83.76 70.53 10.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.061 -3.524 . . . . 0.0 112.68 -167.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t -89.61 150.16 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 -170.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t -112.73 120.65 42.24 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.8 t60 . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t -164.69 137.78 4.84 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 -171.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -84.3 141.08 8.92 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -134.57 7.78 3.58 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.319 -2.738 . . . . 0.0 107.379 -157.235 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m -79.76 155.22 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 112.858 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t -136.92 144.95 43.73 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 46.1 t60 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t -154.03 138.8 17.06 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -81.11 149.72 17.51 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.355 29.7 mt-10 -132.98 32.54 3.76 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 129.681 3.193 . . . . 0.0 108.665 -162.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m -126.95 142.38 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 127.161 2.788 . . . . 0.0 110.489 173.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t -92.7 171.64 8.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 73.1 t60 . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t -150.17 143.21 24.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 120.829 1.649 . . . . 0.0 112.371 -176.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -78.39 120.12 4.77 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.73 31.8 0.11 Allowed 'General case' 0 C--O 1.236 0.385 0 CA-C-O 116.253 -1.832 . . . . 0.0 115.208 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -100.21 149.41 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 -170.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t -92.79 124.83 37.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 40.0 t60 . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 7.0 t -138.96 121.02 15.66 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -164.022 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -57.44 127.6 26.12 Favored 'Trans proline' 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -129.65 33.84 4.41 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -131.86 148.85 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 C-N-CA 128.151 2.58 . . . . 0.0 105.415 -167.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 42.6 t -112.16 128.41 56.22 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.445 -0.709 0 CA-C-O 122.267 1.032 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 120.817 0.342 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo . . . . . 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 116.913 -1.518 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 20.8 Cg_exo . . . . . 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 122.518 1.151 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 122.272 1.034 . . . . 0.0 109.102 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo . . . . . 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 122.331 1.062 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 122.736 1.255 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.444 -0.763 0 CA-C-O 117.414 -1.279 . . . . 0.0 114.392 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 124.283 1.992 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 118.92 -0.562 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo . . . . . 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t . . . . . 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t . . . . . 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t . . . . . 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t . . . . . 0 C--O 1.219 -0.531 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo . . . . . 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 116.354 -1.784 . . . . 0.0 114.277 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' CYS . . . . . 0.45 ' C ' HD12 ' A' ' 5' ' ' ILE . 49.4 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 123.482 1.61 . . . . 0.0 110.563 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.45 HD12 ' C ' ' A' ' 4' ' ' CYS . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo . . . . . 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo . . . . . 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.445 -0.71 0 CA-C-O 117.479 -1.248 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 117.199 -1.381 . . . . 0.0 112.858 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo . . . . . 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 123.124 1.44 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.222 -0.35 0 CA-C-O 118.204 -0.903 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.405 HD12 ' HD2' ' A' ' 6' ' ' PRO . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HD2' HD12 ' A' ' 5' ' ' ILE . 24.7 Cg_exo . . . . . 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo . . . . . 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.443 -0.808 0 CA-C-O 125.037 2.351 . . . . 0.0 105.415 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 . . . . . 0 N--CA 1.45 -0.443 1 CA-C-O 110.606 -4.521 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' DPR . . . . . 0.448 ' C ' HG23 ' A' ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' DVA . . . . . 0.448 HG23 ' C ' ' A' ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t -144.39 144.89 31.64 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 113.536 -1.665 . . . . 0.0 113.217 164.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.89 162.81 38.46 Favored 'Trans proline' 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -73.79 97.6 2.77 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 125.319 1.637 . . . . 0.0 112.887 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.31 156.86 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 127.815 3.197 . . . . 0.0 113.038 -167.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m -103.75 141.8 35.46 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t -128.35 -173.93 3.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.728 168.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -78.03 153.26 28.64 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -76.82 104.35 7.27 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 117.082 -3.511 . . . . 0.0 108.845 -174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m -131.45 155.02 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 119.574 -1.954 . . . . 0.0 114.215 -176.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m -93.1 150.36 20.57 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.512 -0.501 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t -143.51 134.4 25.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 20.8 Cg_exo -67.17 152.11 80.25 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.24 101.31 4.61 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.822 2.049 . . . . 0.0 108.808 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m -153.41 152.22 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 C-N-CA 128.47 2.708 . . . . 0.0 108.908 -163.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m -97.58 156.39 16.54 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-O 116.02 -1.943 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t -147.32 135.46 21.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.886 -2.87 . . . . 0.0 109.102 -168.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -64.8 154.88 70.5 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -85.02 84.38 7.74 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 128.188 2.595 . . . . 0.0 112.505 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -136.05 159.18 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 120.328 -1.483 . . . . 0.0 112.94 -166.121 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -86.59 148.24 25.57 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t -150.43 147.58 27.72 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 118.439 -2.663 . . . . 0.0 113.145 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.13 172.38 4.15 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -164.23 142.79 7.28 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 126.468 2.355 . . . . 0.0 105.662 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m -60.4 155.51 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.56 1.544 . . . . 0.0 108.057 -167.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t -161.41 139.37 9.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.237 0.432 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t -141.02 137.32 32.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 125.515 1.526 . . . . 0.0 114.392 -175.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.92 156.84 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -158.76 135.18 9.29 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 169.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m -76.76 134.61 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 126.497 2.373 . . . . 0.0 106.779 172.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t -147.75 138.85 23.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.1 127.5 9.96 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -78.06 162.99 28.57 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -67.01 104.39 1.38 Allowed 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.19 0.904 . . . . 0.0 110.031 -171.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m -126.01 147.53 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 127.191 2.197 . . . . 0.0 113.002 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t -129.02 157.04 42.82 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 2' ' ' DPR . 94.1 m-70 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 122.988 1.375 . . . . 0.0 108.414 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' DPR . . . . . 0.416 ' HD3' ' HA ' ' A' ' 1' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t -148.36 148.49 30.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 118.658 -2.526 . . . . 0.0 112.485 -172.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -72.05 153.53 57.55 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -151.62 141.69 22.17 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.167 1.787 . . . . 0.0 112.266 167.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m -100.92 159.52 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 126.646 1.978 . . . . 0.0 115.255 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t -156.63 121.35 4.54 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m80 . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 113.198 -3.286 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -138.23 143.39 40.11 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 163.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo -62.02 145.61 96.6 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -84.81 117.46 23.87 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 124.538 2.114 . . . . 0.0 109.424 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -133.26 140.06 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 -164.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t -132.1 166.1 22.55 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t -170.79 144.54 2.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 -167.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -68.29 123.3 10.41 Favored 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -130.81 14.95 5.33 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 170.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m -58.61 134.16 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 -166.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t -142.8 149.48 38.69 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.7 t60 . . . . . 0 N--CA 1.447 -0.609 0 CA-C-O 116.146 -1.883 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.24 108.56 3.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 -166.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -75.31 157.62 41.37 Favored 'Trans proline' 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.78 112.35 3.2 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 127.016 3.293 . . . . 0.0 108.897 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t -129.86 147.84 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 130.043 3.337 . . . . 0.0 116.023 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t -131.89 132.66 43.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 38.7 t-80 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t -148.43 141.04 24.45 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 125.168 1.387 . . . . 0.0 113.075 -175.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -66.96 157.35 62.05 Favored 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.03 97.19 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 124.896 1.372 . . . . 0.0 113.374 168.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m -141.1 154.2 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 130.354 3.462 . . . . 0.0 114.277 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -138.18 167.27 22.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.45 ' C ' HD12 ' A' ' 5' ' ' ILE . 49.4 t -144.33 154.64 43.24 Favored 'General case' 0 N--CA 1.453 -0.301 1 O-C-N 115.279 -4.638 . . . . 0.0 110.563 -172.39 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.45 HD12 ' C ' ' A' ' 4' ' ' CYS . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 144.43 54.32 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.258 33.7 tt0 -64.75 126.9 29.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 115.332 -2.547 . . . . 0.0 107.22 174.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.2 157.25 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t -142.18 131.25 23.21 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.5 t60 . . . . . 0 CA--C 1.51 -0.566 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t -127.03 145.06 50.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.746 2.018 . . . . 0.0 110.52 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -72.05 127.95 13.41 Favored 'Trans proline' 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -55.09 96.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.94 1.829 . . . . 0.0 111.197 178.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m -134.21 157.11 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 124.763 1.225 . . . . 0.0 107.96 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t -150.0 150.79 32.31 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 t60 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 118.18 -0.915 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t -157.2 139.41 14.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -75.81 152.27 36.9 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -58.72 110.72 1.06 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.175 1.39 . . . . 0.0 113.43 174.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.47 154.36 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 127.548 2.339 . . . . 0.0 112.076 -172.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t -135.89 133.5 37.77 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.2 t60 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 114.117 -2.849 . . . . 0.0 112.845 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t -156.76 130.72 8.37 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.462 1.101 . . . . 0.0 108.438 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -59.66 139.03 86.91 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -83.76 70.53 10.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.061 -3.524 . . . . 0.0 112.68 -167.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t -89.61 150.16 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 -170.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t -112.73 120.65 42.24 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.8 t60 . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t -164.69 137.78 4.84 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 -171.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -84.3 141.08 8.92 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -134.57 7.78 3.58 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.319 -2.738 . . . . 0.0 107.379 -157.235 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m -79.76 155.22 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 112.858 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t -136.92 144.95 43.73 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 46.1 t60 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t -154.03 138.8 17.06 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -81.11 149.72 17.51 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.355 29.7 mt-10 -132.98 32.54 3.76 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 129.681 3.193 . . . . 0.0 108.665 -162.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m -126.95 142.38 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 127.161 2.788 . . . . 0.0 110.489 173.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t -92.7 171.64 8.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 73.1 t60 . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t -150.17 143.21 24.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 120.829 1.649 . . . . 0.0 112.371 -176.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.405 HD12 ' HD2' ' A' ' 6' ' ' PRO . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HD2' HD12 ' A' ' 5' ' ' ILE . 24.7 Cg_exo -78.39 120.12 4.77 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.73 31.8 0.11 Allowed 'General case' 0 C--O 1.236 0.385 0 CA-C-O 116.253 -1.832 . . . . 0.0 115.208 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -100.21 149.41 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 -170.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t -92.79 124.83 37.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' HIS . . . . . 0.418 ' HA ' ' HD2' ' A' ' 2' ' ' DPR . 57.5 t-80 . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' DPR . . . . . 0.418 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.0 t -138.96 121.02 15.66 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -164.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -57.44 127.6 26.12 Favored 'Trans proline' 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -129.65 33.84 4.41 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -131.86 148.85 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 C-N-CA 128.151 2.58 . . . . 0.0 105.415 -167.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.16 128.41 56.22 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t . . . . . 0 N--CA 1.445 -0.709 0 CA-C-O 122.267 1.032 . . . . 0.0 113.217 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo . . . . . 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.45 -0.436 0 N-CA-C 113.038 0.755 . . . . 0.0 113.038 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m . . . . . 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.448 -0.537 0 CA-C-O 120.817 0.342 . . . . 0.0 110.728 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo . . . . . 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.449 -0.479 0 CA-C-O 116.913 -1.518 . . . . 0.0 114.215 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m . . . . . 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t . . . . . 0 CA--C 1.516 -0.327 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 20.8 Cg_exo . . . . . 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.451 -0.422 0 CA-C-O 122.518 1.151 . . . . 0.0 108.908 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t . . . . . 0 N--CA 1.451 -0.421 0 CA-C-O 122.272 1.034 . . . . 0.0 109.102 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo . . . . . 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m . . . . . 0 N--CA 1.448 -0.53 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 122.331 1.062 . . . . 0.0 113.145 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 122.736 1.255 . . . . 0.0 108.057 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t . . . . . 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.444 -0.763 0 CA-C-O 117.414 -1.279 . . . . 0.0 114.392 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m . . . . . 0 N--CA 1.452 -0.366 0 N-CA-C 106.779 -1.563 . . . . 0.0 106.779 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.45 -0.431 0 CA-C-O 124.283 1.992 . . . . 0.0 113.002 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t . . . . . 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t . . . . . 0 N--CA 1.451 -0.42 0 CA-C-O 118.92 -0.562 . . . . 0.0 112.485 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo . . . . . 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m . . . . . 0 N--CA 1.45 -0.452 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t . . . . . 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo . . . . . 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m . . . . . 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t . . . . . 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t . . . . . 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo . . . . . 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m . . . . . 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t . . . . . 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t . . . . . 0 N--CA 1.454 -0.236 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.45 -0.439 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t . . . . . 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t . . . . . 0 C--O 1.219 -0.531 0 N-CA-C 113.075 0.768 . . . . 0.0 113.075 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo . . . . . 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.45 -0.432 0 CA-C-O 116.354 -1.784 . . . . 0.0 114.277 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t . . . . . 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . 0.45 ' C ' HD12 ' A' ' 5' ' ' ILE . 49.4 t . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 123.482 1.61 . . . . 0.0 110.563 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.45 HD12 ' C ' ' A' ' 4' ' ' CYS . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m . . . . . 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t . . . . . 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 118.108 -0.949 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo . . . . . 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m . . . . . 0 N--CA 1.447 -0.612 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t . . . . . 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo . . . . . 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.445 -0.71 0 CA-C-O 117.479 -1.248 . . . . 0.0 112.076 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t . . . . . 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t . . . . . 0 N--CA 1.455 -0.217 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t . . . . . 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t . . . . . 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo . . . . . 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m . . . . . 0 N--CA 1.448 -0.558 0 CA-C-O 117.199 -1.381 . . . . 0.0 112.858 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t . . . . . 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo . . . . . 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m . . . . . 0 N--CA 1.444 -0.752 0 CA-C-O 123.124 1.44 . . . . 0.0 110.489 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 C--O 1.222 -0.35 0 CA-C-O 118.204 -0.903 . . . . 0.0 112.371 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.405 HD12 ' HD2' ' A' ' 6' ' ' PRO . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HD2' HD12 ' A' ' 5' ' ' ILE . 24.7 Cg_exo . . . . . 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t . . . . . 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.0 t . . . . . 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo . . . . . 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m . . . . . 0 N--CA 1.443 -0.808 0 CA-C-O 125.037 2.351 . . . . 0.0 105.415 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t . . . . . 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 17.7 t-80 . . . . . 0 N--CA 1.45 -0.443 1 CA-C-O 110.606 -4.521 . . . . 0.0 111.374 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . 0.448 ' C ' HG23 ' A' ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . 0.448 HG23 ' C ' ' A' ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 49.5 t -144.39 144.89 31.64 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-N 113.536 -1.665 . . . . 0.0 113.217 164.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.0 mm -115.84 109.29 45.42 Favored Pre-proline 0 N--CA 1.454 -0.271 0 CA-C-N 111.115 -2.766 . . . . 0.0 105.767 173.765 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.89 162.81 38.46 Favored 'Trans proline' 0 N--CA 1.444 -1.423 0 C-N-CA 121.997 1.798 . . . . 0.0 109.936 173.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.8 tt0 -73.79 97.6 2.77 Favored 'General case' 0 N--CA 1.449 -0.512 0 O-C-N 125.319 1.637 . . . . 0.0 112.887 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -134.31 156.86 41.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 O-C-N 127.815 3.197 . . . . 0.0 113.038 -167.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 88.6 m -103.75 141.8 35.46 Favored 'General case' 0 N--CA 1.448 -0.552 0 O-C-N 118.856 -2.403 . . . . 0.0 108.909 169.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 25.2 t-80 . . . . . 0 N--CA 1.448 -0.57 0 N-CA-C 110.501 -0.185 . . . . 0.0 110.501 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.5 t -128.35 -173.93 3.09 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.728 168.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.8 mm -139.59 130.88 14.69 Favored Pre-proline 0 N--CA 1.446 -0.662 0 C-N-CA 128.877 2.871 . . . . 0.0 110.095 164.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_endo -78.03 153.26 28.64 Favored 'Trans proline' 0 N--CA 1.446 -1.308 0 C-N-CA 124.568 3.512 . . . . 0.0 114.841 -176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -76.82 104.35 7.27 Favored 'General case' 0 C--N 1.328 -0.368 0 O-C-N 117.082 -3.511 . . . . 0.0 108.845 -174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 19.2 m -131.45 155.02 41.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 O-C-N 119.574 -1.954 . . . . 0.0 114.215 -176.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 36.0 m -93.1 150.36 20.57 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 127.102 2.751 . . . . 0.0 111.966 169.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 . . . . . 0 CA--C 1.512 -0.501 0 CA-C-O 118.52 -0.752 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 39.1 t -143.51 134.4 25.38 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.181 1.549 . . . . 0.0 115.181 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.424 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 29.4 mm -88.74 119.9 70.06 Favored Pre-proline 0 N--CA 1.445 -0.718 0 CA-C-O 116.722 -1.608 . . . . 0.0 112.402 177.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 5' ' ' ILE . 20.8 Cg_exo -67.17 152.11 80.25 Favored 'Trans proline' 0 N--CA 1.447 -1.242 0 C-N-CA 123.531 2.821 . . . . 0.0 116.063 -172.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -75.24 101.31 4.61 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 126.822 2.049 . . . . 0.0 108.808 -177.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.6 m -153.41 152.22 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 C-N-CA 128.47 2.708 . . . . 0.0 108.908 -163.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 m -97.58 156.39 16.54 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 109.814 -3.357 . . . . 0.0 111.202 164.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 . . . . . 0 N--CA 1.445 -0.703 0 CA-C-O 116.02 -1.943 . . . . 0.0 111.251 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 37.2 t -147.32 135.46 21.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 110.886 -2.87 . . . . 0.0 109.102 -168.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 20.1 mm -96.64 113.31 62.47 Favored Pre-proline 0 N--CA 1.445 -0.679 0 C-N-CA 131.227 3.811 . . . . 0.0 102.145 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_endo -64.8 154.88 70.5 Favored 'Trans proline' 0 N--CA 1.445 -1.346 0 N-CA-C 120.149 3.096 . . . . 0.0 120.149 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -85.02 84.38 7.74 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 128.188 2.595 . . . . 0.0 112.505 175.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.1 m -136.05 159.18 39.07 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 O-C-N 120.328 -1.483 . . . . 0.0 112.94 -166.121 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 60.8 m -86.59 148.24 25.57 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 124.0 1.857 . . . . 0.0 106.54 168.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 92.3 m-70 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.9 t -150.43 147.58 27.72 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 118.439 -2.663 . . . . 0.0 113.145 -169.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 36.5 mm -118.2 101.41 51.43 Favored Pre-proline 0 C--N 1.342 0.247 0 N-CA-C 106.589 -1.634 . . . . 0.0 106.589 174.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.13 172.38 4.15 Favored 'Trans proline' 0 N--CA 1.452 -0.922 0 O-C-N 115.65 -2.868 . . . . 0.0 111.673 174.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -164.23 142.79 7.28 Favored 'General case' 0 C--N 1.329 -0.292 0 O-C-N 126.468 2.355 . . . . 0.0 105.662 168.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . 0.253 30.3 m -60.4 155.51 3.56 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.56 1.544 . . . . 0.0 108.057 -167.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.9 t -161.41 139.37 9.27 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.596 2.358 . . . . 0.0 112.121 173.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 . . . . . 0 C--O 1.237 0.432 0 N-CA-C 106.487 -1.671 . . . . 0.0 106.487 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 6.7 t -141.02 137.32 32.88 Favored 'General case' 0 N--CA 1.444 -0.763 0 C-N-CA 125.515 1.526 . . . . 0.0 114.392 -175.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.7 mm -107.83 112.27 61.99 Favored Pre-proline 0 N--CA 1.449 -0.514 0 CA-C-O 115.881 -2.009 . . . . 0.0 109.188 170.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.92 156.84 46.69 Favored 'Trans proline' 0 N--CA 1.456 -0.683 0 CA-C-N 121.086 1.424 . . . . 0.0 112.624 171.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -158.76 135.18 9.29 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 169.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 35.6 m -76.76 134.61 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.366 0 O-C-N 126.497 2.373 . . . . 0.0 106.779 172.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.7 t -147.75 138.85 23.48 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.526 1.53 . . . . 0.0 110.131 169.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 6.1 m-70 . . . . . 0 N--CA 1.446 -0.663 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.028 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 2.1 t -152.1 127.5 9.96 Favored 'General case' 0 N--CA 1.439 -0.98 0 N-CA-C 119.09 2.996 . . . . 0.0 119.09 -173.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 49.0 mm -125.02 104.8 29.46 Favored Pre-proline 0 N--CA 1.447 -0.579 0 N-CA-C 103.715 -2.698 . . . . 0.0 103.715 167.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -78.06 162.99 28.57 Favored 'Trans proline' 0 N--CA 1.453 -0.911 0 C-N-CA 123.291 2.661 . . . . 0.0 112.482 173.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -67.01 104.39 1.38 Allowed 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 119.19 0.904 . . . . 0.0 110.031 -171.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.8 m -126.01 147.53 30.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 127.191 2.197 . . . . 0.0 113.002 178.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 21.4 t -129.02 157.04 42.82 Favored 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 126.966 2.106 . . . . 0.0 115.949 173.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.416 ' HA ' ' HD3' ' A' ' 2' ' ' DPR . 94.1 m-70 . . . . . 0 N--CA 1.448 -0.543 0 CA-C-O 122.988 1.375 . . . . 0.0 108.414 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . 0.416 ' HD3' ' HA ' ' A' ' 1' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.1 t -148.36 148.49 30.43 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 118.658 -2.526 . . . . 0.0 112.485 -172.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.1 mt -119.08 98.03 50.77 Favored Pre-proline 0 N--CA 1.453 -0.315 0 C-N-CA 127.665 2.386 . . . . 0.0 109.372 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -72.05 153.53 57.55 Favored 'Trans proline' 0 N--CA 1.446 -1.309 0 C-N-CA 124.172 3.248 . . . . 0.0 113.822 -168.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -151.62 141.69 22.17 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 126.167 1.787 . . . . 0.0 112.266 167.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.9 m -100.92 159.52 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 126.646 1.978 . . . . 0.0 115.255 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.6 t -156.63 121.35 4.54 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 119.401 -2.062 . . . . 0.0 111.64 -174.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 m80 . . . . . 0 N--CA 1.446 -0.651 0 CA-C-O 113.198 -3.286 . . . . 0.0 109.858 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -138.23 143.39 40.11 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 117.994 -1.003 . . . . 0.0 111.228 163.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.275 71.5 mt -118.15 94.5 46.81 Favored Pre-proline 0 N--CA 1.45 -0.453 0 O-C-N 126.623 2.452 . . . . 0.0 106.865 159.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . 0.269 19.3 Cg_exo -62.02 145.61 96.6 Favored 'Trans proline' 0 N--CA 1.454 -0.845 0 C-N-CA 124.509 3.473 . . . . 0.0 115.173 -174.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -84.81 117.46 23.87 Favored 'General case' 0 C--O 1.222 -0.386 0 CA-C-O 124.538 2.114 . . . . 0.0 109.424 -170.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -133.26 140.06 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 N-CA-C 104.316 -2.476 . . . . 0.0 104.316 -164.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.8 t -132.1 166.1 22.55 Favored 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 125.954 1.702 . . . . 0.0 113.837 166.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 18.5 t60 . . . . . 0 N--CA 1.45 -0.464 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 11' ' ' CYS . 23.2 t -170.79 144.54 2.28 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-O 124.558 2.123 . . . . 0.0 108.779 -167.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 61.3 mt -126.76 76.62 74.82 Favored Pre-proline 0 C--O 1.236 0.372 0 N-CA-C 105.329 -2.101 . . . . 0.0 105.329 -177.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -68.29 123.3 10.41 Favored 'Trans proline' 0 N--CA 1.451 -0.989 0 O-C-N 117.713 -1.782 . . . . 0.0 111.634 -161.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 29.9 mt-10 -130.81 14.95 5.33 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 115.19 1.552 . . . . 0.0 115.19 170.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 33.9 m -58.61 134.16 23.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 CA-C-O 123.745 1.736 . . . . 0.0 114.577 -166.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.504 ' HA ' ' HA ' ' A' ' 4' ' ' CYS . 37.5 t -142.8 149.48 38.69 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 128.099 2.56 . . . . 0.0 111.862 175.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 65.7 t60 . . . . . 0 N--CA 1.447 -0.609 0 CA-C-O 116.146 -1.883 . . . . 0.0 111.875 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 42.2 t -150.24 108.56 3.78 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 116.974 -1.489 . . . . 0.0 111.366 -166.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.9 mt -91.93 119.53 68.3 Favored Pre-proline 0 N--CA 1.449 -0.476 0 O-C-N 127.879 3.237 . . . . 0.0 105.704 161.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -75.31 157.62 41.37 Favored 'Trans proline' 0 N--CA 1.446 -1.292 1 C-N-CA 125.462 4.108 . . . . 0.0 110.752 168.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -64.78 112.35 3.2 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 127.016 3.293 . . . . 0.0 108.897 -177.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 6.2 t -129.86 147.84 33.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 130.043 3.337 . . . . 0.0 116.023 177.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 12.6 t -131.89 132.66 43.81 Favored 'General case' 0 N--CA 1.447 -0.622 0 O-C-N 119.848 -1.782 . . . . 0.0 113.215 170.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 63.6 t60 . . . . . 0 N--CA 1.454 -0.227 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.9 t -148.43 141.04 24.45 Favored 'General case' 0 C--O 1.219 -0.531 0 C-N-CA 125.168 1.387 . . . . 0.0 113.075 -175.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.5 mt -126.38 83.85 63.35 Favored Pre-proline 0 N--CA 1.452 -0.372 0 N-CA-C 102.893 -3.003 . . . . 0.0 102.893 175.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -66.96 157.35 62.05 Favored 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 122.789 2.326 . . . . 0.0 113.532 -172.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -54.03 97.19 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.618 0 O-C-N 124.896 1.372 . . . . 0.0 113.374 168.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 21.1 m -141.1 154.2 20.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 C-N-CA 130.354 3.462 . . . . 0.0 114.277 -177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 11.8 t -138.18 167.27 22.18 Favored 'General case' 0 N--CA 1.448 -0.525 0 CA-C-O 122.499 1.142 . . . . 0.0 108.963 174.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 44.7 t60 . . . . . 0 N--CA 1.444 -0.743 0 N-CA-C 109.212 -0.662 . . . . 0.0 109.212 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.45 ' C ' HD12 ' A' ' 5' ' ' ILE . 49.4 t -144.33 154.64 43.24 Favored 'General case' 0 N--CA 1.453 -0.301 1 O-C-N 115.279 -4.638 . . . . 0.0 110.563 -172.39 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.45 HD12 ' C ' ' A' ' 4' ' ' CYS . 2.1 mp -125.34 110.73 26.29 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 129.344 3.058 . . . . 0.0 103.014 -178.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 144.43 54.32 Favored 'Trans proline' 0 N--CA 1.452 -0.92 0 C-N-CA 121.819 1.679 . . . . 0.0 112.21 171.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.258 33.7 tt0 -64.75 126.9 29.4 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 115.332 -2.547 . . . . 0.0 107.22 174.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 4.7 m -87.2 157.25 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.723 0 N-CA-C 115.043 1.497 . . . . 0.0 115.043 -177.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.6 t -142.18 131.25 23.21 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 120.081 1.309 . . . . 0.0 112.394 169.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.5 t60 . . . . . 0 CA--C 1.51 -0.566 0 CA-C-O 117.914 -1.041 . . . . 0.0 112.382 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 1.1 t -127.03 145.06 50.85 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.746 2.018 . . . . 0.0 110.52 -176.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 42.9 mt -116.52 110.05 43.14 Favored Pre-proline 0 N--CA 1.446 -0.649 0 CA-C-O 115.182 -2.342 . . . . 0.0 106.84 154.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -72.05 127.95 13.41 Favored 'Trans proline' 0 N--CA 1.445 -1.379 0 O-C-N 124.894 1.997 . . . . 0.0 117.113 -167.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.7 tp10 -55.09 96.04 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.94 1.829 . . . . 0.0 111.197 178.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 3.7 m -134.21 157.11 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 124.763 1.225 . . . . 0.0 107.96 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 43.3 t -150.0 150.79 32.31 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-O 126.108 2.861 . . . . 0.0 107.579 -175.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 67.4 t60 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 118.18 -0.915 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 48.3 t -157.2 139.41 14.56 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 116.867 2.173 . . . . 0.0 116.867 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.5 mp -120.83 112.75 33.48 Favored Pre-proline 0 N--CA 1.444 -0.769 0 CA-C-N 113.732 -1.576 . . . . 0.0 112.573 -175.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -75.81 152.27 36.9 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.023 1.149 . . . . 0.0 112.034 -178.01 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -58.72 110.72 1.06 Allowed 'General case' 0 N--CA 1.448 -0.574 0 C-N-CA 125.175 1.39 . . . . 0.0 113.43 174.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.47 154.36 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 C-N-CA 127.548 2.339 . . . . 0.0 112.076 -172.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.3 t -135.89 133.5 37.77 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.54 1.136 . . . . 0.0 108.965 -175.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 31.2 t60 . . . . . 0 N--CA 1.457 -0.091 0 CA-C-O 114.117 -2.849 . . . . 0.0 112.845 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 16.1 t -156.76 130.72 8.37 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 124.462 1.101 . . . . 0.0 108.438 176.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.1 tt -119.26 138.76 26.7 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-O 115.701 -2.095 . . . . 0.0 111.05 170.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -59.66 139.03 86.91 Favored 'Trans proline' 0 N--CA 1.457 -0.667 0 CA-C-N 120.952 1.376 . . . . 0.0 113.908 170.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -83.76 70.53 10.37 Favored 'General case' 0 N--CA 1.447 -0.593 0 O-C-N 117.061 -3.524 . . . . 0.0 112.68 -167.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 40.4 t -89.61 150.16 3.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-O 124.382 2.039 . . . . 0.0 112.878 -170.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.7 t -112.73 120.65 42.24 Favored 'General case' 0 CA--C 1.513 -0.447 0 C-N-CA 125.424 1.49 . . . . 0.0 113.283 160.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.8 t60 . . . . . 0 CA--C 1.517 -0.325 0 CA-C-O 119.672 -0.204 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 36.2 t -164.69 137.78 4.84 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 105.664 -1.976 . . . . 0.0 105.664 -171.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.428 5.2 tp -101.95 103.26 28.21 Favored Pre-proline 0 N--CA 1.454 -0.242 0 CA-C-O 115.457 -2.211 . . . . 0.0 108.091 168.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -84.3 141.08 8.92 Favored 'Trans proline' 0 N--CA 1.447 -1.232 0 CA-C-N 122.93 2.082 . . . . 0.0 112.636 -168.331 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -134.57 7.78 3.58 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 118.319 -2.738 . . . . 0.0 107.379 -157.235 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.5 m -79.76 155.22 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.407 1.483 . . . . 0.0 112.858 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.3 t -136.92 144.95 43.73 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 114.649 1.351 . . . . 0.0 114.649 172.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 46.1 t60 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 3.8 t -154.03 138.8 17.06 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 115.591 -2.147 . . . . 0.0 110.233 174.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -153.05 105.95 2.64 Favored Pre-proline 0 N--CA 1.449 -0.509 1 N-CA-C 97.858 -4.867 . . . . 0.0 97.858 166.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -81.11 149.72 17.51 Favored 'Trans proline' 0 N--CA 1.451 -1.0 0 O-C-N 122.968 0.983 . . . . 0.0 113.643 -176.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . 0.355 29.7 mt-10 -132.98 32.54 3.76 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 129.681 3.193 . . . . 0.0 108.665 -162.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 2.1 m -126.95 142.38 43.59 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.752 0 O-C-N 127.161 2.788 . . . . 0.0 110.489 173.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . 0.252 40.8 t -92.7 171.64 8.87 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 124.923 2.297 . . . . 0.0 107.931 176.752 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 73.1 t60 . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 117.899 -1.048 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 40.4 t -150.17 143.21 24.89 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 120.829 1.649 . . . . 0.0 112.371 -176.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.405 HD12 ' HD2' ' A' ' 6' ' ' PRO . 5.7 tp -156.06 134.9 7.62 Favored Pre-proline 0 N--CA 1.456 -0.154 0 CA-C-N 120.963 1.71 . . . . 0.0 111.556 -169.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.405 ' HD2' HD12 ' A' ' 5' ' ' ILE . 24.7 Cg_exo -78.39 120.12 4.77 Favored 'Trans proline' 0 N--CA 1.452 -0.93 0 CA-C-N 121.084 1.423 . . . . 0.0 115.328 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -75.73 31.8 0.11 Allowed 'General case' 0 C--O 1.236 0.385 0 CA-C-O 116.253 -1.832 . . . . 0.0 115.208 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.8 m -100.21 149.41 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 115.705 1.743 . . . . 0.0 115.705 -170.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 18.7 t -92.79 124.83 37.07 Favored 'General case' 0 N--CA 1.443 -0.824 0 O-C-N 120.053 -1.655 . . . . 0.0 111.691 173.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.418 ' HA ' ' HD2' ' A' ' 2' ' ' DPR . 40.0 t60 . . . . . 0 N--CA 1.447 -0.595 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' DPR . . . . . 0.418 ' HD2' ' HA ' ' A' ' 1' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' DVA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . . . . . . . . . 7.0 t -138.96 121.02 15.66 Favored 'General case' 0 C--O 1.223 -0.296 0 N-CA-C 114.624 1.342 . . . . 0.0 114.624 -164.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.316 6.0 tp -146.38 76.8 11.94 Favored Pre-proline 0 C--N 1.332 -0.175 0 N-CA-C 103.293 -2.854 . . . . 0.0 103.293 178.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -57.44 127.6 26.12 Favored 'Trans proline' 0 N--CA 1.441 -1.61 0 O-C-N 118.866 -1.176 . . . . 0.0 113.071 179.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' DPR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 23.9 mt-10 -129.65 33.84 4.41 Favored 'General case' 0 N--CA 1.442 -0.864 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 178.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' DLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 16.5 m -131.86 148.85 32.31 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 C-N-CA 128.151 2.58 . . . . 0.0 105.415 -167.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 42.6 t -112.16 128.41 56.22 Favored 'General case' 0 N--CA 1.448 -0.555 0 O-C-N 119.591 -1.943 . . . . 0.0 114.333 169.612 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' DGL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_