data_1aj1_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 1aj1 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.252 0.1 OUTLIER . . . . . 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t . . . . . 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.267 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.255 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.261 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.259 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 N--CA 1.5 2.046 0 CA-C-O 119.205 -0.426 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 118.811 -0.614 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.262 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 119.307 -0.377 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.228 -0.415 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t . . . . . 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.257 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.27 -0.395 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 119.029 -0.51 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -93.77 72.94 4.24 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 154.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.15 -115.84 5.0 Favored Glycine 0 CA--C 1.549 2.197 0 N-CA-C 108.359 -1.897 . . . . 0.0 108.359 -162.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -143.19 76.71 1.54 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.828 1.814 . . . . 0.0 107.733 153.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t -77.67 -75.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 158.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.492 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.252 0.1 OUTLIER 52.47 119.22 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.492 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.4 mt -110.3 64.22 0.61 Allowed 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 119.902 1.228 . . . . 0.0 109.921 173.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm -141.92 110.65 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 -177.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.92 -39.67 0.02 OUTLIER Glycine 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -139.02 -36.07 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -173.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -96.03 72.47 2.95 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 157.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.88 -115.45 4.66 Favored Glycine 0 CA--C 1.549 2.165 0 N-CA-C 108.401 -1.88 . . . . 0.0 108.401 -161.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -144.24 75.27 1.45 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 119.826 1.813 . . . . 0.0 108.174 154.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t -78.4 -74.07 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 158.522 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.47 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.17 123.08 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.47 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -96.71 42.49 1.09 Allowed 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 178.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.67 108.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 179.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -154.69 -43.95 0.02 OUTLIER Glycine 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -135.97 -49.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 C-N-CA 124.713 1.205 . . . . 0.0 111.594 -174.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -99.64 71.0 1.69 Allowed 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 152.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.45 -110.94 3.23 Favored Glycine 0 CA--C 1.55 2.223 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -163.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -142.93 75.7 1.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 123.276 1.512 . . . . 0.0 108.2 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t -79.2 -70.59 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 148.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.408 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 30.45 124.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.408 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.0 mp -115.97 61.26 0.71 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.882 1.219 . . . . 0.0 109.611 173.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp -142.42 111.56 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.404 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.16 -47.37 0.02 OUTLIER Glycine 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p -141.59 -33.95 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -91.23 69.42 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 122.36 1.076 . . . . 0.0 109.368 153.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.16 -113.26 4.27 Favored Glycine 0 CA--C 1.549 2.166 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 -161.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.92 80.15 1.61 Allowed 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.588 1.694 . . . . 0.0 107.644 155.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t -77.99 -76.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 153.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.461 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.267 0.1 OUTLIER 49.71 120.05 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.461 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -98.27 55.33 1.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.358 1.075 . . . . 0.0 112.42 177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -140.55 110.57 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.08 -32.17 0.02 OUTLIER Glycine 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t -136.57 -51.07 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 C-N-CA 124.52 1.128 . . . . 0.0 111.79 -171.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -97.94 70.31 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 152.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.6 -110.81 3.22 Favored Glycine 0 CA--C 1.551 2.292 0 N-CA-C 110.091 -1.203 . . . . 0.0 110.091 -163.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -142.17 78.37 1.62 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 123.571 1.653 . . . . 0.0 107.598 160.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t -78.84 -74.64 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 146.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.496 ' SG ' ' HG2' ' A' ' 7' ' ' DBB 0.255 0.1 OUTLIER 38.11 121.09 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.496 ' HG2' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.26 61.21 0.61 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 119.66 1.118 . . . . 0.0 109.859 175.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp -143.09 114.13 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.56 -33.19 0.02 OUTLIER Glycine 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t -136.57 -49.41 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 124.49 1.116 . . . . 0.0 111.841 -172.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.5 m -96.64 71.75 2.64 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 156.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.41 -114.33 4.12 Favored Glycine 0 CA--C 1.549 2.21 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 -161.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -145.28 78.33 1.55 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.585 1.692 . . . . 0.0 108.023 156.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t -78.54 -73.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 152.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.463 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 44.11 122.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.463 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -98.2 43.09 1.07 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 177.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.88 108.58 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.44 -44.92 0.02 OUTLIER Glycine 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t -135.98 -47.96 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.822 1.249 . . . . 0.0 111.689 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -92.1 72.43 5.48 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 154.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.58 -115.6 4.77 Favored Glycine 0 CA--C 1.55 2.275 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -161.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.6 m-90 -144.69 80.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.773 1.787 . . . . 0.0 107.565 152.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t -77.84 -76.09 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 154.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.261 0.1 OUTLIER 52.31 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -98.07 55.3 1.15 Allowed 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.384 1.088 . . . . 0.0 112.488 177.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm -140.55 110.78 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 -177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.04 -32.71 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -136.57 -50.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 C-N-CA 124.522 1.129 . . . . 0.0 111.817 -171.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -92.23 72.46 5.37 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 154.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.53 -115.52 4.75 Favored Glycine 0 CA--C 1.55 2.234 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 -161.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -144.7 80.21 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.76 1.78 . . . . 0.0 107.577 152.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t -77.81 -76.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.485 ' SG ' ' HG2' ' A' ' 7' ' ' DBB 0.259 0.1 OUTLIER 52.04 119.21 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.485 ' HG2' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -98.24 55.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.271 1.034 . . . . 0.0 112.448 177.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm -140.75 110.3 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 -176.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.95 -39.65 0.02 OUTLIER Glycine 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p -140.63 -34.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.8 m -93.82 72.31 4.17 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 155.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.78 -115.37 4.85 Favored Glycine 0 CA--C 1.549 2.205 0 N-CA-C 108.407 -1.877 . . . . 0.0 108.407 -162.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -143.27 76.56 1.53 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 119.841 1.821 . . . . 0.0 107.804 153.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t -77.69 -76.02 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 158.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.501 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 51.74 120.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.501 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.9 mt -107.63 63.11 0.62 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 119.744 1.156 . . . . 0.0 110.034 173.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm -140.73 108.88 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.99 -35.02 0.02 OUTLIER Glycine 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -134.27 -50.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 C-N-CA 124.596 1.158 . . . . 0.0 111.913 -172.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -93.89 71.83 4.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 154.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.74 -114.66 4.39 Favored Glycine 0 CA--C 1.55 2.224 0 N-CA-C 108.629 -1.788 . . . . 0.0 108.629 -161.481 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.73 79.69 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.685 1.743 . . . . 0.0 107.666 154.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t -77.91 -75.65 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 153.306 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.479 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.35 117.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.479 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -95.77 51.62 1.28 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 122.167 0.984 . . . . 0.0 113.046 177.495 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm -140.15 109.27 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 -176.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -158.79 -35.57 0.02 OUTLIER Glycine 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.37 -46.8 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 C-N-CA 124.61 1.164 . . . . 0.0 112.236 -173.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -91.97 72.38 5.59 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 154.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.65 -115.48 4.75 Favored Glycine 0 CA--C 1.55 2.254 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -161.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -144.73 80.33 1.62 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 119.738 1.769 . . . . 0.0 107.536 152.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t -77.78 -76.12 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.262 0.1 OUTLIER 52.34 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -97.74 55.01 1.18 Allowed 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.32 1.057 . . . . 0.0 112.479 177.562 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm -140.67 110.35 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.4 -33.98 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t -134.18 -51.96 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 C-N-CA 124.48 1.112 . . . . 0.0 111.755 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -94.31 71.9 3.84 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 154.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.77 -114.66 4.39 Favored Glycine 0 CA--C 1.549 2.218 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -161.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.96 80.04 1.61 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 119.626 1.713 . . . . 0.0 107.629 154.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t -77.82 -75.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 152.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.511 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.09 120.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.511 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -110.27 64.53 0.61 Allowed 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 119.844 1.202 . . . . 0.0 109.802 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -147.51 107.79 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 -175.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.61 -36.08 0.02 OUTLIER Glycine 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.42 -48.88 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.611 1.164 . . . . 0.0 112.035 -172.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 t -94.81 72.08 3.52 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 156.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 88.86 -115.01 4.36 Favored Glycine 0 CA--C 1.55 2.257 0 N-CA-C 108.524 -1.831 . . . . 0.0 108.524 -160.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 -145.22 78.18 1.55 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 119.696 1.748 . . . . 0.0 107.989 155.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t -78.62 -74.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 154.235 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.22 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.469 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.85 53.71 1.12 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.123 0.963 . . . . 0.0 112.563 177.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm -139.27 107.71 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.71 -46.45 0.02 OUTLIER Glycine 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p -142.2 -33.76 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -174.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -94.42 71.95 3.77 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 154.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.54 -114.49 4.34 Favored Glycine 0 CA--C 1.549 2.202 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -161.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.73 79.94 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.676 1.738 . . . . 0.0 107.647 154.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t -77.94 -75.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 152.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.495 ' SG ' ' HG1' ' A' ' 7' ' ' DBB 0.257 0.1 OUTLIER 48.13 120.16 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.495 ' HG1' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -109.95 61.3 0.6 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 119.626 1.103 . . . . 0.0 109.913 175.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp -142.3 113.06 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -161.58 -33.4 0.02 OUTLIER Glycine 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t -136.3 -50.6 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.569 1.148 . . . . 0.0 111.743 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -95.91 72.77 3.02 Favored 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 157.7 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.45 -115.99 4.85 Favored Glycine 0 CA--C 1.549 2.194 0 N-CA-C 108.347 -1.901 . . . . 0.0 108.347 -161.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -144.05 75.23 1.46 Allowed 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 119.89 1.845 . . . . 0.0 108.076 154.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t -78.55 -73.65 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 159.249 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.491 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.25 122.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' DBB . . . . . 0.491 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 34.5 tp -134.64 73.39 1.48 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 120.38 1.446 . . . . 0.0 108.442 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt -148.37 106.48 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -150.07 -50.68 0.02 OUTLIER Glycine 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -132.44 -44.9 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 C-N-CA 124.904 1.281 . . . . 0.0 111.893 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.252 0.1 OUTLIER . . . . . 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t . . . . . 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.267 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.255 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.261 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.259 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 N--CA 1.5 2.046 0 CA-C-O 119.205 -0.426 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 118.811 -0.614 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.262 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 119.307 -0.377 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.228 -0.415 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t . . . . . 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.257 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.27 -0.395 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 119.029 -0.51 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -93.77 72.94 4.24 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 154.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.15 -115.84 5.0 Favored Glycine 0 CA--C 1.549 2.197 0 N-CA-C 108.359 -1.897 . . . . 0.0 108.359 -162.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -143.19 76.71 1.54 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.828 1.814 . . . . 0.0 107.733 153.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t -77.67 -75.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 158.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.252 0.1 OUTLIER 52.47 119.22 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.4 mt -110.3 64.22 0.61 Allowed 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 119.902 1.228 . . . . 0.0 109.921 173.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm -141.92 110.65 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 -177.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.92 -39.67 0.02 OUTLIER Glycine 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -139.02 -36.07 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -173.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -96.03 72.47 2.95 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 157.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.88 -115.45 4.66 Favored Glycine 0 CA--C 1.549 2.165 0 N-CA-C 108.401 -1.88 . . . . 0.0 108.401 -161.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -144.24 75.27 1.45 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 119.826 1.813 . . . . 0.0 108.174 154.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t -78.4 -74.07 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 158.522 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.461 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.17 123.08 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.461 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.442 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.6 pt? -96.71 42.49 1.09 Allowed 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.67 108.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 179.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -154.69 -43.95 0.02 OUTLIER Glycine 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -135.97 -49.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 C-N-CA 124.713 1.205 . . . . 0.0 111.594 -174.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -99.64 71.0 1.69 Allowed 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 152.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.45 -110.94 3.23 Favored Glycine 0 CA--C 1.55 2.223 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -163.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -142.93 75.7 1.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 123.276 1.512 . . . . 0.0 108.2 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t -79.2 -70.59 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 148.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 30.45 124.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.0 mp -115.97 61.26 0.71 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.882 1.219 . . . . 0.0 109.611 173.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp -142.42 111.56 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.16 -47.37 0.02 OUTLIER Glycine 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p -141.59 -33.95 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -91.23 69.42 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 122.36 1.076 . . . . 0.0 109.368 153.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.16 -113.26 4.27 Favored Glycine 0 CA--C 1.549 2.166 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 -161.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.92 80.15 1.61 Allowed 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.588 1.694 . . . . 0.0 107.644 155.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t -77.99 -76.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 153.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.452 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.267 0.1 OUTLIER 49.71 120.05 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.452 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.27 55.33 1.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.358 1.075 . . . . 0.0 112.42 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -140.55 110.57 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.08 -32.17 0.02 OUTLIER Glycine 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t -136.57 -51.07 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 C-N-CA 124.52 1.128 . . . . 0.0 111.79 -171.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -97.94 70.31 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 152.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.6 -110.81 3.22 Favored Glycine 0 CA--C 1.551 2.292 0 N-CA-C 110.091 -1.203 . . . . 0.0 110.091 -163.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -142.17 78.37 1.62 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 123.571 1.653 . . . . 0.0 107.598 160.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t -78.84 -74.64 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 146.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.255 0.1 OUTLIER 38.11 121.09 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.26 61.21 0.61 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 119.66 1.118 . . . . 0.0 109.859 175.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp -143.09 114.13 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.56 -33.19 0.02 OUTLIER Glycine 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t -136.57 -49.41 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 124.49 1.116 . . . . 0.0 111.841 -172.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.5 m -96.64 71.75 2.64 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 156.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.41 -114.33 4.12 Favored Glycine 0 CA--C 1.549 2.21 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 -161.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -145.28 78.33 1.55 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.585 1.692 . . . . 0.0 108.023 156.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t -78.54 -73.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 152.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.455 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 44.11 122.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.455 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.6 pt? -98.2 43.09 1.07 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 177.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.88 108.58 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.44 -44.92 0.02 OUTLIER Glycine 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t -135.98 -47.96 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.822 1.249 . . . . 0.0 111.689 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -92.1 72.43 5.48 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 154.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.58 -115.6 4.77 Favored Glycine 0 CA--C 1.55 2.275 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -161.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.6 m-90 -144.69 80.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.773 1.787 . . . . 0.0 107.565 152.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t -77.84 -76.09 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 154.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.261 0.1 OUTLIER 52.31 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.469 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.07 55.3 1.15 Allowed 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.384 1.088 . . . . 0.0 112.488 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm -140.55 110.78 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 -177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.04 -32.71 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -136.57 -50.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 C-N-CA 124.522 1.129 . . . . 0.0 111.817 -171.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -92.23 72.46 5.37 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 154.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.53 -115.52 4.75 Favored Glycine 0 CA--C 1.55 2.234 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 -161.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -144.7 80.21 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.76 1.78 . . . . 0.0 107.577 152.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t -77.81 -76.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.475 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.259 0.1 OUTLIER 52.04 119.21 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.475 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.24 55.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.271 1.034 . . . . 0.0 112.448 177.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm -140.75 110.3 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 -176.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.95 -39.65 0.02 OUTLIER Glycine 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p -140.63 -34.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.8 m -93.82 72.31 4.17 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 155.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.78 -115.37 4.85 Favored Glycine 0 CA--C 1.549 2.205 0 N-CA-C 108.407 -1.877 . . . . 0.0 108.407 -162.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -143.27 76.56 1.53 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 119.841 1.821 . . . . 0.0 107.804 153.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t -77.69 -76.02 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 158.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.494 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 51.74 120.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.494 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.9 mt -107.63 63.11 0.62 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 119.744 1.156 . . . . 0.0 110.034 173.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm -140.73 108.88 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.99 -35.02 0.02 OUTLIER Glycine 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -134.27 -50.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 C-N-CA 124.596 1.158 . . . . 0.0 111.913 -172.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -93.89 71.83 4.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 154.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.74 -114.66 4.39 Favored Glycine 0 CA--C 1.55 2.224 0 N-CA-C 108.629 -1.788 . . . . 0.0 108.629 -161.481 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.73 79.69 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.685 1.743 . . . . 0.0 107.666 154.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t -77.91 -75.65 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 153.306 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.35 117.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.469 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.509 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -95.77 51.62 1.28 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 122.167 0.984 . . . . 0.0 113.046 177.495 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm -140.15 109.27 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 -176.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -158.79 -35.57 0.02 OUTLIER Glycine 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.37 -46.8 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 C-N-CA 124.61 1.164 . . . . 0.0 112.236 -173.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -91.97 72.38 5.59 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 154.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.65 -115.48 4.75 Favored Glycine 0 CA--C 1.55 2.254 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -161.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -144.73 80.33 1.62 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 119.738 1.769 . . . . 0.0 107.536 152.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t -77.78 -76.12 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.262 0.1 OUTLIER 52.34 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.468 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.491 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -97.74 55.01 1.18 Allowed 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.32 1.057 . . . . 0.0 112.479 177.562 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm -140.67 110.35 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.4 -33.98 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t -134.18 -51.96 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 C-N-CA 124.48 1.112 . . . . 0.0 111.755 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -94.31 71.9 3.84 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 154.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.77 -114.66 4.39 Favored Glycine 0 CA--C 1.549 2.218 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -161.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.96 80.04 1.61 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 119.626 1.713 . . . . 0.0 107.629 154.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t -77.82 -75.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 152.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.09 120.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.502 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -110.27 64.53 0.61 Allowed 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 119.844 1.202 . . . . 0.0 109.802 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -147.51 107.79 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 -175.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.61 -36.08 0.02 OUTLIER Glycine 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.42 -48.88 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.611 1.164 . . . . 0.0 112.035 -172.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 t -94.81 72.08 3.52 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 156.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 88.86 -115.01 4.36 Favored Glycine 0 CA--C 1.55 2.257 0 N-CA-C 108.524 -1.831 . . . . 0.0 108.524 -160.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 -145.22 78.18 1.55 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 119.696 1.748 . . . . 0.0 107.989 155.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t -78.62 -74.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 154.235 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.459 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.22 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.459 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.85 53.71 1.12 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.123 0.963 . . . . 0.0 112.563 177.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm -139.27 107.71 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.71 -46.45 0.02 OUTLIER Glycine 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p -142.2 -33.76 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -174.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -94.42 71.95 3.77 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 154.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.54 -114.49 4.34 Favored Glycine 0 CA--C 1.549 2.202 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -161.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.73 79.94 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.676 1.738 . . . . 0.0 107.647 154.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t -77.94 -75.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 152.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.257 0.1 OUTLIER 48.13 120.16 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.484 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -109.95 61.3 0.6 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 119.626 1.103 . . . . 0.0 109.913 175.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp -142.3 113.06 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -161.58 -33.4 0.02 OUTLIER Glycine 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t -136.3 -50.6 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.569 1.148 . . . . 0.0 111.743 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -95.91 72.77 3.02 Favored 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 157.7 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.45 -115.99 4.85 Favored Glycine 0 CA--C 1.549 2.194 0 N-CA-C 108.347 -1.901 . . . . 0.0 108.347 -161.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -144.05 75.23 1.46 Allowed 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 119.89 1.845 . . . . 0.0 108.076 154.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t -78.55 -73.65 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 159.249 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.474 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.25 122.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' DBB . . . . . 0.474 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 34.5 tp -134.64 73.39 1.48 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 120.38 1.446 . . . . 0.0 108.442 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt -148.37 106.48 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -150.07 -50.68 0.02 OUTLIER Glycine 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -132.44 -44.9 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 C-N-CA 124.904 1.281 . . . . 0.0 111.893 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.252 0.1 OUTLIER . . . . . 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t . . . . . 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 1.985 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.594 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t . . . . . 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.267 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm . . . . . 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.499 2.017 0 CA-C-O 119.266 -0.397 . . . . 0.0 111.79 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t . . . . . 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.255 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t . . . . . 0 N--CA 1.499 2.016 0 CA-C-O 119.185 -0.436 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t . . . . . 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t . . . . . 0 N--CA 1.499 2.008 0 CA-C-O 119.143 -0.456 . . . . 0.0 111.689 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.261 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm . . . . . 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 2.014 0 CA-C-O 119.253 -0.404 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.259 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p . . . . . 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t . . . . . 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t . . . . . 0 N--CA 1.5 2.046 0 CA-C-O 119.205 -0.426 . . . . 0.0 111.913 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm . . . . . 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.499 1.979 0 CA-C-O 118.811 -0.614 . . . . 0.0 112.236 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t . . . . . 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.262 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm . . . . . 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t . . . . . 0 N--CA 1.5 2.039 0 CA-C-O 119.307 -0.377 . . . . 0.0 111.755 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt . . . . . 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.228 -0.415 . . . . 0.0 112.035 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t . . . . . 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t . . . . . 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . 0.257 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t . . . . . 0 N--CA 1.499 2.007 0 CA-C-O 119.27 -0.395 . . . . 0.0 111.743 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t . . . . . 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t . . . . . 0 N--CA 1.499 1.993 0 CA-C-O 119.029 -0.51 . . . . 0.0 111.893 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -93.77 72.94 4.24 Favored 'General case' 0 CA--C 1.565 1.534 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 154.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 93.15 -115.84 5.0 Favored Glycine 0 CA--C 1.549 2.197 0 N-CA-C 108.359 -1.897 . . . . 0.0 108.359 -162.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.5 m95 -143.19 76.71 1.54 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.828 1.814 . . . . 0.0 107.733 153.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.285 58.8 t -77.67 -75.92 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 105.933 -1.877 . . . . 0.0 105.933 158.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.252 0.1 OUTLIER 52.47 119.22 0.0 OUTLIER 'General case' 0 CA--C 1.561 1.393 0 N-CA-C 118.733 2.864 . . . . 0.0 118.733 139.321 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 85.4 mt -110.3 64.22 0.61 Allowed 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 119.902 1.228 . . . . 0.0 109.921 173.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 21.5 mm -141.92 110.65 2.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 104.808 -2.293 . . . . 0.0 104.808 -177.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.297 9.6 tp10 58.75 53.98 5.55 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.871 1.268 . . . . 0.0 113.598 170.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.6 m -76.41 -28.69 56.78 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 114.519 1.303 . . . . 0.0 114.519 169.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.92 -39.67 0.02 OUTLIER Glycine 0 CA--C 1.545 1.925 0 N-CA-C 117.497 1.759 . . . . 0.0 117.497 -173.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.4 p -139.02 -36.07 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 -173.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 36.6 mm -77.24 -64.81 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.021 0 CA-C-N 119.574 1.079 . . . . 0.0 111.387 -168.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.51 -162.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.586 0.754 . . . . 0.0 111.225 171.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.02 64.74 5.89 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-O 123.48 1.61 . . . . 0.0 112.906 161.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.6 t . . . . . 0 CA--C 1.543 0.685 0 CA-C-O 124.573 2.13 . . . . 0.0 107.768 102.525 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.4 m -96.03 72.47 2.95 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 157.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.88 -115.45 4.66 Favored Glycine 0 CA--C 1.549 2.165 0 N-CA-C 108.401 -1.88 . . . . 0.0 108.401 -161.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -144.24 75.27 1.45 Allowed 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 119.826 1.813 . . . . 0.0 108.174 154.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.29 53.7 t -78.4 -74.07 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 158.522 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.461 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.17 123.08 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 118.659 2.837 . . . . 0.0 118.659 138.805 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.461 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.442 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.6 pt? -96.71 42.49 1.09 Allowed 'General case' 0 N--CA 1.496 1.852 0 N-CA-C 114.23 1.196 . . . . 0.0 114.23 178.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.67 108.02 1.92 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 179.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.396 10.1 pt-20 53.37 55.72 8.33 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.794 1.776 . . . . 0.0 115.794 172.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.72 -26.37 62.46 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.028 1.121 . . . . 0.0 114.028 164.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -154.69 -43.95 0.02 OUTLIER Glycine 0 CA--C 1.543 1.834 0 N-CA-C 117.333 1.693 . . . . 0.0 117.333 -172.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -135.97 -49.0 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.985 0 C-N-CA 124.713 1.205 . . . . 0.0 111.594 -174.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -66.84 -61.09 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 C-N-CA 124.771 1.229 . . . . 0.0 112.564 -165.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.19 -164.84 0.95 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 123.347 0.659 . . . . 0.0 110.982 169.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.8 61.64 5.25 Favored 'General case' 0 N--CA 1.498 1.927 0 CA-C-O 123.586 1.66 . . . . 0.0 113.298 165.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.515 0 N-CA-C 106.018 -1.845 . . . . 0.0 106.018 103.529 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.5 t -99.64 71.0 1.69 Allowed 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 152.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.45 -110.94 3.23 Favored Glycine 0 CA--C 1.55 2.223 0 N-CA-C 109.988 -1.245 . . . . 0.0 109.988 -163.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 86.2 m95 -142.93 75.7 1.5 Allowed 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 123.276 1.512 . . . . 0.0 108.2 162.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.284 44.2 t -79.2 -70.59 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 N-CA-C 106.369 -1.715 . . . . 0.0 106.369 148.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 12' ' ' CYS . 0.1 OUTLIER 30.45 124.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.966 3.321 . . . . 0.0 119.966 137.435 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.0 mp -115.97 61.26 0.71 Allowed 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 119.882 1.219 . . . . 0.0 109.611 173.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.5 mp -142.42 111.56 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.444 0 N-CA-C 104.484 -2.413 . . . . 0.0 104.484 176.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.387 8.7 pt-20 54.37 53.49 10.78 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 116.458 2.022 . . . . 0.0 116.458 172.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.409 ' HA ' ' SG ' ' A' ' 6' ' ' CYS . 87.0 m -71.72 -28.05 63.42 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 114.139 1.163 . . . . 0.0 114.139 164.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -151.16 -47.37 0.02 OUTLIER Glycine 0 N--CA 1.483 1.828 0 N-CA-C 116.986 1.555 . . . . 0.0 116.986 -171.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.1 p -141.59 -33.95 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.571 1.787 0 N-CA-C 115.136 1.532 . . . . 0.0 115.136 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -73.26 -65.34 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 CA-C-N 119.613 1.097 . . . . 0.0 110.732 -171.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.16 -164.19 0.78 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.664 0.786 . . . . 0.0 111.187 170.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.71 61.33 5.05 Favored 'General case' 0 N--CA 1.499 1.984 0 CA-C-O 123.556 1.646 . . . . 0.0 113.478 165.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.539 0.528 0 N-CA-C 106.102 -1.814 . . . . 0.0 106.102 103.396 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 92.2 p -91.23 69.42 6.07 Favored 'General case' 0 N--CA 1.492 1.642 0 CA-C-O 122.36 1.076 . . . . 0.0 109.368 153.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.16 -113.26 4.27 Favored Glycine 0 CA--C 1.549 2.166 0 N-CA-C 108.491 -1.844 . . . . 0.0 108.491 -161.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.92 80.15 1.61 Allowed 'General case' 0 N--CA 1.489 1.5 0 CA-C-N 119.588 1.694 . . . . 0.0 107.644 155.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.7 t -77.99 -76.19 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 105.851 -1.907 . . . . 0.0 105.851 153.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.452 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.267 0.1 OUTLIER 49.71 120.05 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 119.237 3.051 . . . . 0.0 119.237 140.911 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.452 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.49 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.27 55.33 1.12 Allowed 'General case' 0 N--CA 1.495 1.781 0 CA-C-O 122.358 1.075 . . . . 0.0 112.42 177.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.7 mm -140.55 110.57 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 N-CA-C 104.619 -2.363 . . . . 0.0 104.619 -176.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.309 9.4 tp10 59.63 53.7 4.87 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 124.8 1.24 . . . . 0.0 113.701 170.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.9 m -75.32 -28.77 59.79 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 169.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.08 -32.17 0.02 OUTLIER Glycine 0 CA--C 1.546 1.973 0 N-CA-C 118.059 1.984 . . . . 0.0 118.059 -176.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.6 t -136.57 -51.07 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 C-N-CA 124.52 1.128 . . . . 0.0 111.79 -171.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 34.2 mm -68.72 -61.4 1.7 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 C-N-CA 124.653 1.181 . . . . 0.0 112.384 -163.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.2 -165.98 1.14 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-O 121.449 0.642 . . . . 0.0 110.909 167.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.22 64.12 6.74 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.489 1.614 . . . . 0.0 112.995 165.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.2 t . . . . . 0 CA--C 1.539 0.552 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 99.596 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.8 m -97.94 70.31 2.12 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.014 -1.106 . . . . 0.0 108.014 152.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.6 -110.81 3.22 Favored Glycine 0 CA--C 1.551 2.292 0 N-CA-C 110.091 -1.203 . . . . 0.0 110.091 -163.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -142.17 78.37 1.62 Allowed 'General case' 0 N--CA 1.49 1.528 0 CA-C-O 123.571 1.653 . . . . 0.0 107.598 160.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.283 58.2 t -78.84 -74.64 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 N-CA-C 105.56 -2.015 . . . . 0.0 105.56 146.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.482 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.255 0.1 OUTLIER 38.11 121.09 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 120.263 3.431 . . . . 0.0 120.263 139.48 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.482 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.26 61.21 0.61 Allowed 'General case' 0 N--CA 1.495 1.813 0 CA-C-N 119.66 1.118 . . . . 0.0 109.859 175.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.7 mp -143.09 114.13 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 N-CA-C 104.886 -2.264 . . . . 0.0 104.886 177.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.314 32.8 tt0 61.4 51.56 4.13 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.844 1.258 . . . . 0.0 113.713 169.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.2 m -75.1 -30.86 61.01 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 114.038 1.125 . . . . 0.0 114.038 169.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.56 -33.19 0.02 OUTLIER Glycine 0 CA--C 1.545 1.961 0 N-CA-C 117.701 1.84 . . . . 0.0 117.701 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.5 t -136.57 -49.41 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 C-N-CA 124.49 1.116 . . . . 0.0 111.841 -172.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.0 mt -68.54 -62.4 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 C-N-CA 124.653 1.181 . . . . 0.0 111.977 -163.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.43 -163.48 0.7 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.366 0.666 . . . . 0.0 110.972 169.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 61.32 5.45 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 123.468 1.604 . . . . 0.0 113.46 165.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.4 t . . . . . 0 CA--C 1.539 0.532 0 N-CA-C 106.253 -1.758 . . . . 0.0 106.253 101.68 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.5 m -96.64 71.75 2.64 Favored 'General case' 0 N--CA 1.49 1.563 0 N-CA-C 107.988 -1.115 . . . . 0.0 107.988 156.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 87.41 -114.33 4.12 Favored Glycine 0 CA--C 1.549 2.21 0 N-CA-C 108.762 -1.735 . . . . 0.0 108.762 -161.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.2 m-90 -145.28 78.33 1.55 Allowed 'General case' 0 N--CA 1.49 1.535 0 CA-C-N 119.585 1.692 . . . . 0.0 108.023 156.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 53.3 t -78.54 -73.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 152.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.455 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 44.11 122.7 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 119.135 3.013 . . . . 0.0 119.135 140.875 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.455 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.6 pt? -98.2 43.09 1.07 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 177.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 2.8 mp -141.88 108.58 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.352 0 N-CA-C 104.486 -2.413 . . . . 0.0 104.486 179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.39 9.4 pt-20 53.08 55.4 8.94 Favored 'General case' 0 CA--C 1.567 1.622 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 172.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.9 m -71.7 -26.75 62.62 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 114.017 1.117 . . . . 0.0 114.017 163.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -153.44 -44.92 0.02 OUTLIER Glycine 0 CA--C 1.544 1.865 0 N-CA-C 117.193 1.637 . . . . 0.0 117.193 -172.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.2 t -135.98 -47.96 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.822 1.249 . . . . 0.0 111.689 -174.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.1 mt -67.15 -62.35 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.09 0 C-N-CA 124.836 1.254 . . . . 0.0 112.004 -165.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.55 -164.97 0.92 Allowed 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 123.444 0.698 . . . . 0.0 111.032 170.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 61.59 5.22 Favored 'General case' 0 N--CA 1.498 1.954 0 CA-C-O 123.6 1.667 . . . . 0.0 113.348 165.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.3 t . . . . . 0 CA--C 1.538 0.519 0 N-CA-C 106.041 -1.837 . . . . 0.0 106.041 103.439 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.6 t -92.1 72.43 5.48 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 154.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.58 -115.6 4.77 Favored Glycine 0 CA--C 1.55 2.275 0 N-CA-C 108.35 -1.9 . . . . 0.0 108.35 -161.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.6 m-90 -144.69 80.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.773 1.787 . . . . 0.0 107.565 152.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.3 t -77.84 -76.09 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 N-CA-C 105.978 -1.86 . . . . 0.0 105.978 154.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.261 0.1 OUTLIER 52.31 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.647 2.832 . . . . 0.0 118.647 141.338 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.469 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.07 55.3 1.15 Allowed 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 122.384 1.088 . . . . 0.0 112.488 177.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.9 mm -140.55 110.78 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 104.617 -2.364 . . . . 0.0 104.617 -177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.302 9.5 tp10 59.31 54.13 4.92 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.897 1.279 . . . . 0.0 113.618 170.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 93.3 m -75.77 -28.49 58.44 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 114.347 1.24 . . . . 0.0 114.347 168.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.04 -32.71 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.05 1.98 . . . . 0.0 118.05 -175.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -136.57 -50.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.014 0 C-N-CA 124.522 1.129 . . . . 0.0 111.817 -171.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.9 mm -68.65 -61.37 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 C-N-CA 124.598 1.159 . . . . 0.0 112.366 -163.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -82.42 -166.02 1.17 Allowed 'General case' 0 N--CA 1.491 1.607 0 CA-C-O 121.418 0.628 . . . . 0.0 110.859 167.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.3 64.1 6.8 Favored 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 123.449 1.595 . . . . 0.0 112.991 165.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.1 t . . . . . 0 CA--C 1.54 0.563 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 99.402 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -92.23 72.46 5.37 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 154.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.53 -115.52 4.75 Favored Glycine 0 CA--C 1.55 2.234 0 N-CA-C 108.375 -1.89 . . . . 0.0 108.375 -161.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.5 m-90 -144.7 80.21 1.62 Allowed 'General case' 0 N--CA 1.488 1.467 0 CA-C-N 119.76 1.78 . . . . 0.0 107.577 152.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.278 59.6 t -77.81 -76.08 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.8 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.475 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.259 0.1 OUTLIER 52.04 119.21 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 118.679 2.844 . . . . 0.0 118.679 141.294 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.475 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -98.24 55.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.271 1.034 . . . . 0.0 112.448 177.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.1 mm -140.75 110.3 3.19 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 104.583 -2.377 . . . . 0.0 104.583 -176.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.3 9.5 tp10 59.19 53.91 5.15 Favored 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 124.874 1.269 . . . . 0.0 113.589 170.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 94.2 m -76.18 -28.82 57.46 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.95 -39.65 0.02 OUTLIER Glycine 0 CA--C 1.545 1.926 0 N-CA-C 117.463 1.745 . . . . 0.0 117.463 -173.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 5.6 p -140.63 -34.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.856 0 N-CA-C 115.669 1.729 . . . . 0.0 115.669 -173.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 67.8 mt -76.76 -65.72 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 119.842 1.201 . . . . 0.0 110.861 -170.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -79.52 -162.91 0.45 Allowed 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 123.693 0.797 . . . . 0.0 111.243 171.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.87 65.47 6.02 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 123.535 1.636 . . . . 0.0 112.796 161.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.1 t . . . . . 0 CA--C 1.543 0.686 0 CA-C-O 124.611 2.148 . . . . 0.0 107.874 103.068 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.8 m -93.82 72.31 4.17 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 155.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 92.78 -115.37 4.85 Favored Glycine 0 CA--C 1.549 2.205 0 N-CA-C 108.407 -1.877 . . . . 0.0 108.407 -162.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -143.27 76.56 1.53 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 119.841 1.821 . . . . 0.0 107.804 153.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.286 58.1 t -77.69 -76.02 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 N-CA-C 105.944 -1.873 . . . . 0.0 105.944 158.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.494 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 51.74 120.48 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 118.98 2.956 . . . . 0.0 118.98 139.12 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.494 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.9 mt -107.63 63.11 0.62 Allowed 'General case' 0 N--CA 1.499 2.002 0 CA-C-N 119.744 1.156 . . . . 0.0 110.034 173.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.2 mm -140.73 108.88 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 N-CA-C 105.128 -2.175 . . . . 0.0 105.128 -177.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.292 34.3 tt0 58.23 55.24 5.21 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 124.85 1.26 . . . . 0.0 113.283 170.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 95.4 m -75.51 -27.8 58.88 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 168.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.99 -35.02 0.02 OUTLIER Glycine 0 CA--C 1.545 1.938 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 -176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.0 t -134.27 -50.02 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.046 0 C-N-CA 124.596 1.158 . . . . 0.0 111.913 -172.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 62.6 mt -71.17 -62.64 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.031 0 C-N-CA 124.565 1.146 . . . . 0.0 111.951 -162.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.09 -163.14 0.51 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.438 0.695 . . . . 0.0 111.334 171.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.84 64.98 5.81 Favored 'General case' 0 N--CA 1.497 1.881 0 CA-C-O 123.569 1.652 . . . . 0.0 112.738 161.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.543 0.683 0 CA-C-O 124.662 2.172 . . . . 0.0 107.783 103.308 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.4 m -93.89 71.83 4.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 154.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.74 -114.66 4.39 Favored Glycine 0 CA--C 1.55 2.224 0 N-CA-C 108.629 -1.788 . . . . 0.0 108.629 -161.481 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.73 79.69 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.685 1.743 . . . . 0.0 107.666 154.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 57.5 t -77.91 -75.65 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 N-CA-C 105.961 -1.866 . . . . 0.0 105.961 153.306 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.469 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.35 117.75 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 119.108 3.003 . . . . 0.0 119.108 141.236 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.469 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.509 HD13 ' H ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -95.77 51.62 1.28 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 122.167 0.984 . . . . 0.0 113.046 177.495 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.7 mm -140.15 109.27 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 N-CA-C 104.778 -2.305 . . . . 0.0 104.778 -176.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.299 35.3 tt0 58.81 53.64 5.69 Favored 'General case' 0 N--CA 1.5 2.039 0 C-N-CA 124.744 1.218 . . . . 0.0 113.585 170.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 89.4 m -75.53 -28.44 59.08 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 114.355 1.242 . . . . 0.0 114.355 168.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -158.79 -35.57 0.02 OUTLIER Glycine 0 CA--C 1.544 1.906 0 N-CA-C 117.326 1.691 . . . . 0.0 117.326 -175.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 88.1 t -137.37 -46.8 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 C-N-CA 124.61 1.164 . . . . 0.0 112.236 -173.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.07 -63.74 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.099 0 C-N-CA 124.587 1.155 . . . . 0.0 111.294 -165.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.18 -166.43 1.04 Allowed 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.523 0.678 . . . . 0.0 110.962 168.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.99 63.76 6.36 Favored 'General case' 0 N--CA 1.496 1.841 0 CA-C-O 123.54 1.638 . . . . 0.0 112.942 165.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 6.0 t . . . . . 0 CA--C 1.538 0.514 0 N-CA-C 106.137 -1.801 . . . . 0.0 106.137 100.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 32.7 t -91.97 72.38 5.59 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 154.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.65 -115.48 4.75 Favored Glycine 0 CA--C 1.55 2.254 0 N-CA-C 108.333 -1.907 . . . . 0.0 108.333 -161.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 16.3 m-90 -144.73 80.33 1.62 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 119.738 1.769 . . . . 0.0 107.536 152.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.279 59.8 t -77.78 -76.12 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 154.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.468 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.262 0.1 OUTLIER 52.34 119.34 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 118.685 2.846 . . . . 0.0 118.685 141.355 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.468 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.491 HD23 ' H ' ' A' ' 8' ' ' LEU . 2.5 pt? -97.74 55.01 1.18 Allowed 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 122.32 1.057 . . . . 0.0 112.479 177.562 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 22.4 mm -140.67 110.35 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 N-CA-C 104.613 -2.365 . . . . 0.0 104.613 -176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 9.6 tp10 59.12 54.32 4.98 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 124.911 1.285 . . . . 0.0 113.548 170.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.7 m -75.67 -27.9 58.5 Favored 'General case' 0 N--CA 1.497 1.899 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 169.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -164.4 -33.98 0.02 OUTLIER Glycine 0 CA--C 1.545 1.958 0 N-CA-C 118.101 2.0 . . . . 0.0 118.101 -176.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 60.4 t -134.18 -51.96 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 C-N-CA 124.48 1.112 . . . . 0.0 111.755 -171.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.5 mm -71.73 -61.47 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.92 0 C-N-CA 124.501 1.121 . . . . 0.0 112.449 -162.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.3 m -80.75 -163.72 0.62 Allowed 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 123.407 0.683 . . . . 0.0 111.228 170.437 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.77 65.46 5.93 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 123.518 1.628 . . . . 0.0 112.779 161.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.6 t . . . . . 0 CA--C 1.543 0.676 0 CA-C-O 124.657 2.17 . . . . 0.0 107.724 102.139 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.5 m -94.31 71.9 3.84 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 108.104 -1.073 . . . . 0.0 108.104 154.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.77 -114.66 4.39 Favored Glycine 0 CA--C 1.549 2.218 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -161.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.0 m-90 -144.96 80.04 1.61 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 119.626 1.713 . . . . 0.0 107.629 154.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.7 t -77.82 -75.55 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 N-CA-C 105.93 -1.878 . . . . 0.0 105.93 152.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.502 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 48.09 120.1 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.406 0 N-CA-C 119.41 3.115 . . . . 0.0 119.41 141.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.502 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 86.0 mt -110.27 64.53 0.61 Allowed 'General case' 0 N--CA 1.499 1.983 0 CA-C-N 119.844 1.202 . . . . 0.0 109.802 173.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 4.8 mt -147.51 107.79 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 105.303 -2.11 . . . . 0.0 105.303 -175.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.298 35.2 tt0 58.82 53.95 5.49 Favored 'General case' 0 N--CA 1.499 2.021 0 C-N-CA 124.738 1.215 . . . . 0.0 113.468 171.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 99.6 m -75.63 -29.22 59.09 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 168.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -160.61 -36.08 0.02 OUTLIER Glycine 0 CA--C 1.546 1.977 0 N-CA-C 117.433 1.733 . . . . 0.0 117.433 -175.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.5 t -133.42 -48.88 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.611 1.164 . . . . 0.0 112.035 -172.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 61.8 mt -71.89 -62.94 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 C-N-CA 124.537 1.135 . . . . 0.0 111.961 -163.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -81.85 -160.32 0.35 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 123.639 0.776 . . . . 0.0 111.136 173.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.53 62.73 5.53 Favored 'General case' 0 N--CA 1.497 1.912 0 CA-C-O 123.423 1.582 . . . . 0.0 113.077 161.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.543 0.673 0 CA-C-O 124.53 2.11 . . . . 0.0 107.666 103.807 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.1 t -94.81 72.08 3.52 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 156.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 88.86 -115.01 4.36 Favored Glycine 0 CA--C 1.55 2.257 0 N-CA-C 108.524 -1.831 . . . . 0.0 108.524 -160.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 17.2 m-90 -145.22 78.18 1.55 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 119.696 1.748 . . . . 0.0 107.989 155.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.289 49.2 t -78.62 -74.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.777 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 154.235 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.459 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.22 123.36 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.46 0 N-CA-C 118.78 2.881 . . . . 0.0 118.78 140.207 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.459 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -97.85 53.71 1.12 Allowed 'General case' 0 N--CA 1.496 1.864 0 CA-C-O 122.123 0.963 . . . . 0.0 112.563 177.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 23.8 mm -139.27 107.71 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 N-CA-C 104.42 -2.437 . . . . 0.0 104.42 -177.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.392 8.4 pt-20 52.3 55.21 9.48 Favored 'General case' 0 CA--C 1.568 1.649 0 N-CA-C 115.952 1.834 . . . . 0.0 115.952 172.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 98.1 m -71.99 -26.41 62.23 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 165.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.71 -46.45 0.02 OUTLIER Glycine 0 CA--C 1.544 1.844 0 N-CA-C 116.935 1.534 . . . . 0.0 116.935 -172.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 6.0 p -142.2 -33.76 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.572 1.794 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -174.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 64.5 mt -73.75 -65.56 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 CA-C-N 119.655 1.116 . . . . 0.0 110.728 -171.234 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -80.0 -166.13 0.96 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 123.541 0.736 . . . . 0.0 111.1 168.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.79 63.76 6.19 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-O 123.654 1.692 . . . . 0.0 113.012 165.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 CA--C 1.539 0.544 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 102.204 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 66.5 m -94.42 71.95 3.77 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 154.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 89.54 -114.49 4.34 Favored Glycine 0 CA--C 1.549 2.202 0 N-CA-C 108.683 -1.767 . . . . 0.0 108.683 -161.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 18.3 m-90 -144.73 79.94 1.61 Allowed 'General case' 0 N--CA 1.489 1.495 0 CA-C-N 119.676 1.738 . . . . 0.0 107.647 154.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.281 58.0 t -77.94 -75.61 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 N-CA-C 105.882 -1.896 . . . . 0.0 105.882 152.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 7' ' ' DBB 0.257 0.1 OUTLIER 48.13 120.16 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 119.379 3.103 . . . . 0.0 119.379 141.323 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.484 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -109.95 61.3 0.6 Allowed 'General case' 0 N--CA 1.496 1.862 0 CA-C-N 119.626 1.103 . . . . 0.0 109.913 175.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 3.6 mp -142.3 113.06 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 N-CA-C 104.958 -2.238 . . . . 0.0 104.958 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.306 33.0 tt0 60.05 54.05 4.33 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 124.933 1.293 . . . . 0.0 113.52 169.245 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.5 m -75.37 -29.32 59.84 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 114.173 1.175 . . . . 0.0 114.173 167.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -161.58 -33.4 0.02 OUTLIER Glycine 0 CA--C 1.546 2.003 0 N-CA-C 117.58 1.792 . . . . 0.0 117.58 -175.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.4 t -136.3 -50.6 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.007 0 C-N-CA 124.569 1.148 . . . . 0.0 111.743 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 33.3 mm -68.32 -61.14 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.008 0 C-N-CA 124.63 1.172 . . . . 0.0 112.585 -163.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 1.2 m -82.74 -163.4 0.7 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 123.323 0.649 . . . . 0.0 110.858 169.358 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.2 61.37 5.4 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 123.506 1.622 . . . . 0.0 113.404 165.322 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.538 0.486 0 N-CA-C 106.233 -1.766 . . . . 0.0 106.233 101.952 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' DAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 33.6 t -95.91 72.77 3.02 Favored 'General case' 0 CA--C 1.564 1.487 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 157.7 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 91.45 -115.99 4.85 Favored Glycine 0 CA--C 1.549 2.194 0 N-CA-C 108.347 -1.901 . . . . 0.0 108.347 -161.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -144.05 75.23 1.46 Allowed 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 119.89 1.845 . . . . 0.0 108.076 154.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . 0.292 54.1 t -78.55 -73.65 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 106.545 -1.65 . . . . 0.0 106.545 159.249 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.474 ' SG ' ' HG3' ' A' ' 7' ' ' DBB . 0.1 OUTLIER 47.25 122.93 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 118.912 2.93 . . . . 0.0 118.912 138.057 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' DBB . . . . . 0.474 ' HG3' ' SG ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 34.5 tp -134.64 73.39 1.48 Allowed 'General case' 0 N--CA 1.496 1.851 0 CA-C-N 120.38 1.446 . . . . 0.0 108.442 165.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 5.9 mt -148.37 106.48 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.392 0 N-CA-C 104.515 -2.402 . . . . 0.0 104.515 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . 0.382 9.5 pt-20 51.09 54.3 11.46 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.948 1.833 . . . . 0.0 115.948 173.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 96.8 m -72.45 -26.76 61.95 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 164.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -150.07 -50.68 0.02 OUTLIER Glycine 0 CA--C 1.541 1.702 0 N-CA-C 116.661 1.425 . . . . 0.0 116.661 -171.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' DBB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 58.3 t -132.44 -44.9 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.993 0 C-N-CA 124.904 1.281 . . . . 0.0 111.893 -176.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.81 -62.5 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.051 0 C-N-CA 124.744 1.218 . . . . 0.0 112.141 -165.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -86.6 -158.74 0.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 123.77 0.828 . . . . 0.0 111.083 176.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.85 61.12 5.05 Favored 'General case' 0 N--CA 1.498 1.959 0 CA-C-O 123.489 1.614 . . . . 0.0 113.272 161.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.2 t . . . . . 0 CA--C 1.542 0.646 0 CA-C-O 124.546 2.117 . . . . 0.0 107.49 105.026 . . . . . . . . 0 0 . 1 stop_ save_