data_1xrz_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 1xrz _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.411 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.411 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 . . . . . 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 122.584 1.183 . . . . 0.0 112.739 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 121.304 0.573 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.45 ' HA ' ' HZ3' ' A' ' 19' ' ' LYS . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.435 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.7 m120 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.45 ' HZ3' ' HA ' ' A' ' 16' ' ' SER . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.456 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.456 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 . . . . . 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 . . . . . 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.306 0.574 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.401 ' N ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.88 0.371 . . . . 0.0 110.295 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.466 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 . . . . . 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.913 0.864 . . . . 0.0 113.15 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.0 OUTLIER -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.482 ' H ' HD21 ' A' ' 17' ' ' ASN . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 . . . . . 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 120.82 0.343 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' THR . . . . . 0.517 ' HG1' ' HZ2' ' A' ' 23' ' ' LYS . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.517 ' HZ2' ' HG1' ' A' ' 20' ' ' THR . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 . . . . . 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HD3' ' H ' ' A' ' 11' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.152 0.501 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.494 ' H ' HD22 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.494 HD22 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.497 1.915 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.26 0.552 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.494 ' HA ' ' HZ3' ' A' ' 19' ' ' LYS . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.494 ' HZ3' ' HA ' ' A' ' 16' ' ' SER . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.994 0.902 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 . . . . . 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 105.863 -1.902 . . . . 0.0 105.863 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 122.081 0.943 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 . . . . . 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.617 0.723 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 . . . . . 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.405 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.405 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 . . . . . 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.576 0.703 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.404 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.433 ' H ' ' HG ' ' A' ' 16' ' ' SER . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.435 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 . . . . . 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 . . . . . 0 N--CA 1.498 1.933 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.392 0.615 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 . . . . . 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 . . . . . 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.52 ' HZ1' ' HZ1' ' A' ' 23' ' ' LYS . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.52 ' HZ1' ' HZ1' ' A' ' 19' ' ' LYS . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 . . . . . 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 69.6 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 . . . . . 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.788 0.804 . . . . 0.0 109.062 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.436 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.436 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 . . . . . 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.173 0.511 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.432 ' HG ' HD21 ' A' ' 17' ' ' ASN . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.432 HD21 ' HG ' ' A' ' 12' ' ' SER . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.426 ' H ' HD22 ' A' ' 17' ' ' ASN . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.493 ' H ' HD21 ' A' ' 17' ' ' ASN . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.46 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.46 ' HZ3' ' CG ' ' A' ' 19' ' ' LYS . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 . . . . . 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.586 0.232 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.881 0.372 . . . . 0.0 111.884 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.445 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.323 0.583 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.415 ' HG ' ' HZ1' ' A' ' 19' ' ' LYS . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.415 ' HZ1' ' HG ' ' A' ' 15' ' ' SER . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.419 ' HD1' ' HG3' ' A' ' 25' ' ' LYS . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.424 ' NE2' ' N ' ' A' ' 5' ' ' CYS . 36.1 tp60 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.424 ' N ' ' NE2' ' A' ' 4' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 mm100 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 3.4 tp10 . . . . . 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 110.839 -0.06 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.404 ' HD2' ' N ' ' A' ' 12' ' ' SER . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 . . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.404 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.405 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 73.8 m-70 . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 122.165 0.984 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.891 0.377 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.8 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.243 0.544 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 . . . . . 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 27.3 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 . . . . . 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.483 0.659 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' SER . . . . . 0.499 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HZ3' ' HZ1' ' A' ' 23' ' ' LYS . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.4 ' HZ1' ' HZ3' ' A' ' 19' ' ' LYS . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 N--CA 1.488 1.449 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 . . . . . 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.463 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.43 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 45.7 m-70 . . . . . 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.2 p -113.61 177.94 4.46 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -114.88 134.53 55.07 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.411 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.411 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -116.64 57.3 0.78 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.4 HD23 ' CE1' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -132.35 129.2 39.13 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.763 0.665 . . . . 0.0 112.302 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.4 ' CE1' HD23 ' A' ' 10' ' ' ALC . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -122.83 -40.23 2.45 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 m 43.49 44.33 4.98 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 113.202 -1.817 . . . . 0.0 113.235 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -128.05 -38.58 1.81 Allowed 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.74 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -121.41 166.77 13.62 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.589 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? . . . . . 0 N--CA 1.502 2.142 0 O-C-N 120.428 -1.42 . . . . 0.0 108.548 -0.035 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 tttm . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 45.9 p -102.04 173.05 6.56 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.156 0.91 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -126.16 160.18 30.89 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.686 -1.597 . . . . 0.0 106.967 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -116.57 60.22 0.74 Allowed 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.534 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.405 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.5 ttp-105 -126.38 127.25 45.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.124 0.89 . . . . 0.0 108.785 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.498 ' CG ' HD13 ' A' ' 10' ' ' ALC . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -101.8 -41.33 6.56 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 t -120.8 -170.03 1.93 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 103.417 -2.808 . . . . 0.0 103.417 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 ttmp? -121.76 -59.29 1.69 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -131.12 82.09 2.03 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 126.117 2.136 . . . . 0.0 109.031 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.417 1.103 . . . . 0.0 108.876 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 119.639 -0.219 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 35.7 p -124.12 159.45 29.98 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.801 0.81 . . . . 0.0 111.899 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -128.82 151.46 49.57 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 112.96 -1.927 . . . . 0.0 107.488 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.589 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -116.82 57.12 0.79 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.589 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -123.39 151.94 42.06 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.93 -1.508 . . . . 0.0 112.739 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.448 ' C ' ' H ' ' A' ' 27' ' ' SER . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -98.2 24.14 7.5 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 25' ' ' LYS . 53.3 m 3.46 -113.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.401 ' O ' ' C ' ' A' ' 29' ' ' GLU . 14.7 ptpt -119.21 -18.8 8.57 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.913 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -15.55 -58.03 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 126.442 2.339 . . . . 0.0 110.102 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.3 tttm . . . . . 0 N--CA 1.488 1.463 0 CA-C-N 112.568 -2.106 . . . . 0.0 106.857 179.555 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.5 tttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.151 0.501 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.556 ' HG1' ' H ' ' A' ' 3' ' ' TYR . 5.2 t -120.49 175.22 6.09 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 114.01 -1.45 . . . . 0.0 113.327 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.556 ' H ' ' HG1' ' A' ' 2' ' ' THR . 12.9 m-85 -107.63 98.09 7.74 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -114.92 57.74 0.72 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.534 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 -124.13 101.85 7.42 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.592 1.183 . . . . 0.0 112.0 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.45 ' HA ' ' HZ3' ' A' ' 19' ' ' LYS . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.435 ' N ' HD21 ' A' ' 17' ' ' ASN . 1.7 m120 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.45 ' HZ3' ' HA ' ' A' ' 16' ' ' SER . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD13 ' A' ' 10' ' ' ALC . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.407 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 -119.95 -52.09 2.22 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.4 t -12.11 86.54 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 N-CA-C 116.46 2.022 . . . . 0.0 116.46 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.65 -178.02 0.08 Allowed 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -113.39 -38.38 4.4 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.43 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.702 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 20.6 pttp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m -113.24 168.35 9.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.212 0.945 . . . . 0.0 108.86 -179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -123.84 117.21 24.36 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.695 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.456 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.456 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -115.77 57.53 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.548 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.6 mmt180 -126.08 133.45 51.67 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.435 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -114.15 -42.39 3.36 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 p 33.11 -74.67 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -120.91 93.28 3.98 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -120.09 74.86 1.06 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 123.634 0.584 . . . . 0.0 111.062 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.427 ' HZ2' ' CB ' ' A' ' 30' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.135 -2.228 . . . . 0.0 110.164 0.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.5 p -128.33 175.16 8.7 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.603 1.19 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -112.55 162.27 15.83 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -109.69 58.18 0.61 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.588 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -121.15 129.56 53.31 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.009 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.423 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -111.33 5.25 19.65 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.1 t -127.12 153.38 46.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 105.065 -2.198 . . . . 0.0 105.065 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 38.34 3.81 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -112.5 -63.41 1.44 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 106.692 -1.595 . . . . 0.0 106.692 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.6 tttm . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 122.383 1.087 . . . . 0.0 109.041 179.845 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mttm . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.6 p -120.11 175.69 5.81 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.796 1.284 . . . . 0.0 114.237 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -119.97 172.24 7.87 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.253 -2.703 . . . . 0.0 107.019 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -112.77 55.69 0.69 Allowed 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.644 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.401 ' N ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -130.32 149.51 51.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.588 1.18 . . . . 0.0 110.295 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.466 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.401 ' CG ' HD13 ' A' ' 10' ' ' ALC . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 -111.74 -30.56 7.27 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.1 m 22.8 97.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -100.27 154.41 18.49 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.353 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -132.14 -60.65 0.9 Allowed 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.773 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.498 1.959 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.319 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.2 p -115.93 171.92 7.48 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.228 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -120.19 154.51 34.71 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.474 -1.239 . . . . 0.0 107.822 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.595 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.93 59.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.595 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -113.79 128.21 56.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.298 0.999 . . . . 0.0 113.15 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.492 ' N ' HD21 ' A' ' 17' ' ' ASN . 0.0 OUTLIER -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.482 ' H ' HD21 ' A' ' 17' ' ' ASN . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -123.27 -57.27 1.69 Allowed 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -40.32 -48.9 2.73 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -116.36 -41.43 3.12 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.188 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -109.95 177.11 4.82 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.642 -179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 24.0 pttm . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 122.581 1.181 . . . . 0.0 109.854 179.561 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.1 m 104.17 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 O-C-N 126.271 2.232 . . . . 0.0 105.627 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -126.49 147.0 49.89 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.109 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.471 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.492 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -115.92 55.32 0.8 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.492 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -122.79 143.47 49.81 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -109.12 -50.28 3.02 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.3 p -17.26 -71.02 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.6 ttmt -124.59 -65.24 1.05 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.262 0.976 . . . . 0.0 113.401 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 21.67 91.53 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 125.406 1.691 . . . . 0.0 114.707 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 122.571 1.177 . . . . 0.0 109.569 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 91.5 mttt . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.3 p -120.24 -174.75 2.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.537 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -110.03 140.88 43.58 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -108.7 52.77 0.7 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.584 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -122.74 132.14 54.1 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.285 0.991 . . . . 0.0 112.805 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.517 ' HG1' ' HZ2' ' A' ' 23' ' ' LYS . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.473 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.517 ' HZ2' ' HG1' ' A' ' 20' ' ' THR . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -79.33 -50.97 10.04 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 t -4.18 90.88 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 O-C-N 125.784 1.928 . . . . 0.0 114.354 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -108.84 170.61 7.93 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.101 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -113.69 152.55 30.32 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.162 0.914 . . . . 0.0 110.098 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 N--CA 1.496 1.838 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.93 -179.981 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.017 0.437 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.4 p -128.69 171.87 11.78 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.439 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -128.93 139.46 52.11 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.487 HE22 ' H2 ' ' A' ' 10' ' ' ALC . 23.7 tp60 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.447 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.538 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -112.01 53.64 0.72 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.538 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HD3' ' H ' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -129.98 133.15 46.6 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.645 0.591 . . . . 0.0 110.45 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.494 ' H ' HD22 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.494 HD22 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.445 ' CG ' HD13 ' A' ' 10' ' ' ALC . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -112.71 -38.85 4.46 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.509 ' HG ' ' H ' ' A' ' 28' ' ' LYS . 30.7 t -106.14 -168.33 1.42 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 179.679 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.509 ' H ' ' HG ' ' A' ' 27' ' ' SER . 17.1 tppt? -119.44 163.72 16.82 Favored 'General case' 0 N--CA 1.503 2.185 0 CA-C-O 121.12 0.486 . . . . 0.0 112.093 -179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.94 -175.77 3.65 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.42 ' H ' ' HZ1' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.458 ' HZ2' ' HG1' ' A' ' 2' ' ' THR . 23.5 ttpp . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.458 ' HG1' ' HZ2' ' A' ' 1' ' ' LYS . 20.4 m -91.72 166.86 12.56 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -122.77 150.69 42.45 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.835 0.709 . . . . 0.0 109.374 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 49.2 tp10 -113.97 59.0 0.67 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.523 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -122.31 137.72 54.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.959 0.787 . . . . 0.0 112.431 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.494 ' HA ' ' HZ3' ' A' ' 19' ' ' LYS . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.494 ' HZ3' ' HA ' ' A' ' 16' ' ' SER . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.426 ' CE1' HD23 ' A' ' 10' ' ' ALC . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -109.57 -39.75 5.06 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.5 p 17.4 59.54 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 125.731 1.894 . . . . 0.0 114.441 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -110.68 -35.64 5.94 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 112.75 -2.023 . . . . 0.0 106.096 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -113.23 135.0 54.31 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 113.277 -1.783 . . . . 0.0 106.969 179.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt . . . . . 0 N--CA 1.496 1.873 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.962 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.575 ' HZ1' ' HH ' ' A' ' 3' ' ' TYR . 12.7 tttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.0 t -120.04 170.28 9.43 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 122.624 1.202 . . . . 0.0 109.966 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.575 ' HH ' ' HZ1' ' A' ' 1' ' ' LYS . 58.2 m-85 -121.46 131.97 54.46 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 111.473 -2.603 . . . . 0.0 104.249 179.833 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -116.47 56.1 0.8 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.509 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.78 131.17 56.89 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 124.402 1.063 . . . . 0.0 113.237 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -111.08 -61.89 1.62 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 m 64.4 -72.43 0.06 Allowed 'General case' 0 N--CA 1.507 2.399 0 O-C-N 125.837 1.961 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -115.5 -179.51 3.66 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 104.193 -2.521 . . . . 0.0 104.193 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -122.93 160.74 25.56 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.896 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt . . . . . 0 N--CA 1.498 1.945 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.906 179.936 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 85.5 tttt . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.6 p -107.22 170.54 7.89 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.035 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 -120.74 156.0 32.74 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.954 -1.93 . . . . 0.0 105.863 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.661 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.48 56.34 0.65 Allowed 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.661 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -142.57 152.65 42.79 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.496 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -112.83 -41.36 3.8 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.7 p -106.13 144.97 32.08 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 125.156 1.535 . . . . 0.0 111.196 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -114.44 177.92 4.47 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 111.113 -2.767 . . . . 0.0 105.666 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -109.66 53.09 0.7 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.022 0.915 . . . . 0.0 109.317 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt . . . . . 0 N--CA 1.505 2.315 0 CA-C-N 112.267 -2.242 . . . . 0.0 116.133 179.876 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 t -118.1 170.4 8.89 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.148 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -131.31 155.13 47.72 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 112.727 -2.033 . . . . 0.0 109.642 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -121.61 61.66 0.93 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.556 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -101.55 129.06 47.56 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 124.243 0.965 . . . . 0.0 112.095 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.407 ' NZ ' ' HZ2' ' A' ' 28' ' ' LYS . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.418 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -114.96 -48.55 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.4 m 112.28 169.41 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 127.267 2.855 . . . . 0.0 104.086 -179.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HZ2' ' NZ ' ' A' ' 19' ' ' LYS . 50.8 tttp -122.13 -58.02 1.74 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -126.36 -51.78 1.51 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.624 -2.08 . . . . 0.0 107.066 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 tttp . . . . . 0 N--CA 1.494 1.755 0 CA-C-N 113.63 -1.623 . . . . 0.0 108.648 -179.934 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.834 0.349 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.9 m -108.16 167.44 10.01 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -130.78 148.46 52.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.405 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.625 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -112.85 59.49 0.64 Allowed 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.625 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.75 141.79 51.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 124.236 0.96 . . . . 0.0 109.616 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -119.21 -42.41 2.68 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -106.43 -168.74 1.46 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.928 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -106.03 103.07 12.47 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.382 -1.735 . . . . 0.0 108.143 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.84 152.92 0.68 Allowed 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.592 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 122.141 0.972 . . . . 0.0 109.125 -179.998 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 47.5 p -111.67 -173.78 2.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -113.54 89.3 3.05 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.404 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -115.64 56.15 0.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.611 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.43 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 13.1 ttm180 -122.69 141.35 51.86 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.433 ' H ' ' HG ' ' A' ' 16' ' ' SER . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 10' ' ' ALC . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -100.9 -55.44 2.57 Favored 'General case' 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.4 p -131.26 161.35 32.47 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -121.68 -71.33 0.74 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.793 1.637 . . . . 0.0 108.256 -0.174 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -129.85 -50.99 1.14 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 114.473 -1.24 . . . . 0.0 109.261 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 122.549 1.166 . . . . 0.0 110.465 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.432 ' HG1' ' HE ' ' A' ' 11' ' ' ARG . 72.1 p -117.21 155.12 29.95 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.625 -179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -125.39 148.09 48.92 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 112.847 -1.979 . . . . 0.0 106.457 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.435 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -118.31 57.34 0.85 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.488 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HE ' ' HG1' ' A' ' 2' ' ' THR . 1.4 ptm180 -122.47 149.42 43.9 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.435 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 -117.18 -43.53 2.84 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.1 t -114.5 -179.98 3.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 124.648 1.218 . . . . 0.0 111.344 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -19.97 108.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 112.572 -2.103 . . . . 0.0 114.82 179.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -151.5 168.86 23.56 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 125.364 1.465 . . . . 0.0 111.481 -0.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 N--CA 1.507 2.396 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.2 p -103.75 166.71 10.25 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 -125.02 177.02 6.29 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 111.976 -2.374 . . . . 0.0 109.325 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.57 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -113.05 55.94 0.69 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.57 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -131.35 152.89 50.19 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.997 -0.681 . . . . 0.0 111.843 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -97.95 24.1 7.34 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.2 p -130.99 -173.65 3.16 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -120.89 50.77 1.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -113.41 -141.89 0.38 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.499 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 pttm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 121.514 0.673 . . . . 0.0 109.404 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.919 0.39 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.41 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 6.5 t -121.44 172.09 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.27 1.033 . . . . 0.0 112.007 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -134.83 167.57 20.63 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 111.55 -2.568 . . . . 0.0 106.694 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -113.22 55.38 0.71 Allowed 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.602 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -118.64 153.36 34.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 124.638 1.212 . . . . 0.0 108.162 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.52 ' HZ1' ' HZ1' ' A' ' 23' ' ' LYS . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 10' ' ' ALC . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.52 ' HZ1' ' HZ1' ' A' ' 19' ' ' LYS . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 64.9 m-70 -118.84 -39.58 2.95 Favored 'General case' 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t 26.89 60.02 0.08 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -117.08 167.8 10.84 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.415 ' CD ' ' N ' ' A' ' 29' ' ' GLU . 9.5 mp0 -109.86 113.37 26.06 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.474 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 29' ' ' GLU . 18.6 ttmm . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 121.903 2.138 . . . . 0.0 108.545 0.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.6 p -132.06 173.75 10.9 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.292 0.995 . . . . 0.0 111.951 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.95 152.31 34.84 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 179.529 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 69.6 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -115.59 57.61 0.74 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.486 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.4 ptp180 -117.24 112.81 21.3 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 113.261 -1.79 . . . . 0.0 109.062 -179.713 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.486 ' CG ' HD13 ' A' ' 10' ' ' ALC . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -109.83 -37.03 5.75 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.1 p 33.96 40.01 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 126.035 2.084 . . . . 0.0 113.438 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -126.22 48.64 2.09 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 102.527 -3.138 . . . . 0.0 102.527 179.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -132.71 71.85 1.48 Allowed 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 112.259 -2.246 . . . . 0.0 105.306 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 N--CA 1.499 1.988 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.675 -179.734 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.1 m 100.53 165.86 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 126.154 2.159 . . . . 0.0 105.381 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -121.86 88.43 2.93 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.436 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -113.51 55.48 0.71 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.486 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 -122.26 112.24 17.91 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.486 ' CG ' HD13 ' A' ' 10' ' ' ALC . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.436 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 -123.12 -38.11 2.63 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.9 m -97.33 -64.76 1.01 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.352 1.033 . . . . 0.0 113.398 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -119.19 153.69 34.53 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.313 1.008 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.56 -43.5 5.87 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 104.596 -2.372 . . . . 0.0 104.596 -0.042 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 mttp . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 m 61.68 162.95 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.299 -2.228 . . . . 0.0 112.272 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -133.37 138.93 46.52 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 113.453 -1.703 . . . . 0.0 109.233 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -121.84 55.18 1.12 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.441 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -111.93 116.7 31.05 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.288 0.992 . . . . 0.0 110.817 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.432 ' HG ' HD21 ' A' ' 17' ' ' ASN . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.432 HD21 ' HG ' ' A' ' 12' ' ' SER . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.441 ' CG ' HD13 ' A' ' 10' ' ' ALC . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -124.62 -48.7 1.79 Allowed 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.9 m -110.83 66.05 0.62 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.926 -1.488 . . . . 0.0 111.087 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.458 ' HZ3' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER -119.14 -48.7 2.42 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.311 -1.768 . . . . 0.0 107.368 179.943 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.458 ' H ' ' HZ3' ' A' ' 28' ' ' LYS . 69.3 mm-40 -128.14 162.83 26.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.208 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 122.428 1.109 . . . . 0.0 109.335 179.822 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.446 ' HZ1' ' HH ' ' A' ' 3' ' ' TYR . 25.4 ttpp . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.4 p -108.43 158.66 17.33 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 122.11 0.957 . . . . 0.0 112.148 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.446 ' HH ' ' HZ1' ' A' ' 1' ' ' LYS . 19.3 m-85 -126.66 149.19 49.66 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 112.423 -2.171 . . . . 0.0 108.262 179.996 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -117.1 59.55 0.76 Allowed 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.533 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 -114.93 129.38 56.7 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -110.27 -40.9 4.54 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 23.2 t -87.22 94.52 9.68 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.812 179.973 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -110.47 -164.48 0.93 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 113.768 -1.56 . . . . 0.0 109.086 179.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.07 45.31 1.12 Allowed 'General case' 0 N--CA 1.503 2.209 0 CA-C-O 121.647 0.737 . . . . 0.0 112.304 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 122.418 1.104 . . . . 0.0 109.862 179.507 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.7 mttm . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 77.1 m -131.91 167.64 19.27 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.746 0.784 . . . . 0.0 109.178 179.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -124.87 96.32 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 179.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.432 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.64 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -119.14 59.88 0.83 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.64 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -110.72 132.2 54.4 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.426 ' H ' HD22 ' A' ' 17' ' ' ASN . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.493 HD21 ' H ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.493 ' H ' HD21 ' A' ' 17' ' ' ASN . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.46 ' CG ' ' HZ3' ' A' ' 23' ' ' LYS . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.46 ' HZ3' ' CG ' ' A' ' 19' ' ' LYS . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -112.6 -44.52 3.33 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.6 m 45.91 24.75 0.25 Allowed 'General case' 0 N--CA 1.502 2.127 0 CA-C-N 113.914 -1.494 . . . . 0.0 114.292 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -124.51 47.78 2.05 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 179.691 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -10.13 -60.63 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 112.379 -2.192 . . . . 0.0 115.755 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 124.65 1.219 . . . . 0.0 111.369 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.564 ' HG1' ' H ' ' A' ' 3' ' ' TYR . 14.5 t -122.77 176.51 5.93 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.564 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.564 ' H ' ' HG1' ' A' ' 2' ' ' THR . 65.6 m-85 -140.46 165.63 26.92 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 111.908 -2.405 . . . . 0.0 110.509 -179.762 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.652 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -114.98 55.62 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.652 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -124.16 157.47 34.61 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.262 -0.975 . . . . 0.0 111.884 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -107.42 -43.6 4.51 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.2 p -124.25 172.88 8.73 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 102.602 -3.11 . . . . 0.0 102.602 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -134.63 71.82 1.45 Allowed 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 -0.153 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -96.35 160.08 14.61 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.047 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.496 1.847 0 CA-C-N 113.525 -1.671 . . . . 0.0 110.255 -179.772 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.107 0.479 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -134.45 178.01 7.32 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.928 179.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -120.91 162.03 20.56 Favored 'General case' 0 N--CA 1.5 2.074 0 CA-C-N 114.625 -1.17 . . . . 0.0 107.938 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.445 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.634 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -115.21 57.46 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.634 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -117.76 143.1 46.54 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 124.827 1.33 . . . . 0.0 109.67 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.415 ' HG ' ' HZ1' ' A' ' 19' ' ' LYS . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.415 ' HZ1' ' HG ' ' A' ' 15' ' ' SER . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.43 ' CG ' HD13 ' A' ' 10' ' ' ALC . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -111.87 -38.48 4.82 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 61.1 p -113.85 56.04 0.71 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 124.781 1.301 . . . . 0.0 112.274 -179.901 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.514 ' NZ ' ' HZ3' ' A' ' 30' ' ' LYS . 62.4 tttp 112.14 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 C-N-CA 127.112 2.165 . . . . 0.0 108.623 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -128.33 -66.17 0.86 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.514 ' HZ3' ' NZ ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.265 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 58.9 m -136.0 171.16 14.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.705 0.628 . . . . 0.0 109.525 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -119.23 139.79 51.3 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.572 179.714 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.424 ' NE2' ' N ' ' A' ' 5' ' ' CYS . 36.1 tp60 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.424 ' N ' ' NE2' ' A' ' 4' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 mm100 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 3.4 tp10 -116.93 54.07 0.88 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.486 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.469 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 7.8 mmt85 -120.82 124.51 45.23 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.839 -179.647 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.486 ' CG ' HD13 ' A' ' 10' ' ' ALC . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -122.9 -48.94 1.99 Allowed 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -126.32 80.07 1.9 Allowed 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -28.36 88.16 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.54 0 O-C-N 124.832 1.332 . . . . 0.0 113.725 179.507 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 5.35 146.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 121.064 3.728 . . . . 0.0 121.064 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.163 0 O-C-N 119.452 -2.03 . . . . 0.0 110.478 0.181 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.2 m -123.7 177.69 5.58 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 114.517 -1.219 . . . . 0.0 108.815 -179.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 -118.56 131.23 56.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.764 0.665 . . . . 0.0 110.444 -179.938 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.509 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -120.79 62.1 0.88 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.509 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.441 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 0.8 OUTLIER -123.48 130.71 53.09 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 179.876 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.404 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.436 ' O ' ' N ' ' A' ' 28' ' ' LYS . 73.8 m-70 -108.14 -55.68 2.34 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -14.5 70.15 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 O-C-N 125.906 2.004 . . . . 0.0 116.091 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' HIS . 14.0 mptt 48.57 54.08 11.13 Favored 'General case' 0 N--CA 1.504 2.275 0 CA-C-O 122.936 1.351 . . . . 0.0 109.671 -179.468 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -114.95 -66.66 1.06 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.475 -2.148 . . . . 0.0 108.51 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.306 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -98.62 172.67 7.34 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 -121.06 133.57 55.24 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.767 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 -113.18 -43.82 3.33 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.531 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -100.78 123.98 45.76 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 113.781 -1.554 . . . . 0.0 113.14 -179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.531 ' CG ' HD13 ' A' ' 10' ' ' ALC . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -100.16 43.38 1.06 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.4 t -126.37 59.16 1.35 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 113.505 -1.68 . . . . 0.0 107.477 179.631 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -123.32 61.44 1.04 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.305 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -120.85 -34.88 3.46 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 113.481 -1.691 . . . . 0.0 109.189 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.4 tptt . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 122.544 1.164 . . . . 0.0 108.153 -179.991 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.4 p -112.18 176.98 4.8 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.988 0.899 . . . . 0.0 109.244 179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -110.23 132.87 53.79 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 112.929 -1.942 . . . . 0.0 105.76 179.898 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.423 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -124.64 58.09 1.24 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.423 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 8.0 tpp85 -118.73 126.46 51.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 124.152 0.908 . . . . 0.0 110.737 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -122.4 -38.12 2.71 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.6 m -108.74 46.55 0.96 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.96 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -9.2 124.04 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 117.072 2.249 . . . . 0.0 117.072 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.457 ' H ' ' HA ' ' A' ' 30' ' ' LYS . 4.7 mm-40 -112.59 -53.75 2.68 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.35 -1.295 . . . . 0.0 110.863 -179.988 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.457 ' HA ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.147 0 CA-C-N 121.95 2.159 . . . . 0.0 111.19 -0.191 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.43 ' H1 ' ' HD2' ' A' ' 1' ' ' LYS . 1.5 mptp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.411 ' HG1' ' H ' ' A' ' 3' ' ' TYR . 0.7 OUTLIER -101.1 174.14 6.14 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 120.509 1.504 . . . . 0.0 109.39 0.043 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . 0.411 ' H ' ' HG1' ' A' ' 2' ' ' THR . 50.1 m-85 -118.33 141.51 48.46 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 179.861 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.8 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.499 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -114.01 55.54 0.73 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.499 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.447 ' HD3' ' C ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -119.87 130.19 54.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.125 0.891 . . . . 0.0 109.872 179.727 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.484 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.407 ' O ' ' CB ' ' A' ' 27' ' ' SER . 78.1 m-70 -111.57 -46.0 3.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 26' ' ' HIS . 86.9 p 119.13 -177.26 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 126.807 2.567 . . . . 0.0 108.786 179.923 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.4 mttp 95.07 161.07 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 126.552 2.408 . . . . 0.0 112.164 179.515 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.05 21.75 8.07 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 113.635 -1.62 . . . . 0.0 109.184 179.974 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.496 1.869 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.181 179.99 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.485 ' N ' ' HA ' ' A' ' 2' ' ' THR . 18.5 pttm . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 . . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.485 ' HA ' ' N ' ' A' ' 1' ' ' LYS . 33.5 p -112.79 160.54 17.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 119.646 -1.909 . . . . 0.0 110.36 -0.055 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -120.87 151.45 39.63 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.755 -1.566 . . . . 0.0 106.858 179.661 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 27.3 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.49 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -118.97 61.39 0.8 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.49 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -110.03 128.59 55.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 124.419 1.074 . . . . 0.0 111.05 -179.658 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.403 ' HA ' ' H1 ' ' A' ' 1' ' ' LYS . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.499 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.499 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HZ3' ' HZ1' ' A' ' 23' ' ' LYS . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.4 ' HZ1' ' HZ3' ' A' ' 19' ' ' LYS . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -107.33 -55.39 2.35 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.9 p 5.5 -76.46 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 O-C-N 125.515 1.76 . . . . 0.0 115.496 -179.662 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -32.66 -41.82 0.07 Allowed 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 179.599 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 6.71 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.502 0 O-C-N 125.717 1.885 . . . . 0.0 113.955 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 113.437 -1.711 . . . . 0.0 115.514 -179.866 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 m -113.38 163.37 14.94 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.9 0.857 . . . . 0.0 109.643 -179.912 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -136.1 92.12 2.76 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.323 -1.762 . . . . 0.0 108.859 -179.895 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -108.67 52.33 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ALC . . . . . 0.427 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -123.69 115.02 20.75 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.44 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.463 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.415 ' CG ' HD13 ' A' ' 10' ' ' ALC . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.43 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 45.7 m-70 -119.73 -28.67 5.2 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 57.8 p 24.31 76.61 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 179.644 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -7.2 -77.71 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.674 2.101 . . . . 0.0 116.674 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -128.98 53.5 1.87 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.306 1.004 . . . . 0.0 111.245 -179.885 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.4 mttm . . . . . 0 N--CA 1.51 2.536 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 179.641 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.5 pp0? -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.441 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.434 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 . . . . . 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 122.584 1.183 . . . . 0.0 112.739 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.0 tp-100 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 121.304 0.573 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.446 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 . . . . . 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 . . . . . 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.405 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.306 0.574 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.446 ' N ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.88 0.371 . . . . 0.0 110.295 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.445 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 . . . . . 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.913 0.864 . . . . 0.0 113.15 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 . . . . . 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 120.82 0.343 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 . . . . . 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.421 ' N ' ' HD3' ' A' ' 11' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.152 0.501 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.618 ' H ' HD21 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.618 HD21 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.497 1.915 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.423 HE21 ' C ' ' A' ' 9' ' ' GLU . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' C ' HE21 ' A' ' 4' ' ' GLN . 49.2 tp10 . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.26 0.552 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.994 0.902 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 . . . . . 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 105.863 -1.902 . . . . 0.0 105.863 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 122.081 0.943 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 19' ' ' LYS . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 . . . . . 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.617 0.723 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.436 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 . . . . . 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.417 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 . . . . . 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.576 0.703 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.502 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.445 ' HA ' ' HZ3' ' A' ' 23' ' ' LYS . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 20' ' ' THR . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.458 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 25' ' ' LYS . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.458 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 . . . . . 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 . . . . . 0 N--CA 1.498 1.933 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.392 0.615 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 18' ' ' LEU . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.401 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 82.4 m-70 . . . . . 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 . . . . . 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.406 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 64.9 m-70 . . . . . 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.2 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 . . . . . 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.426 HH11 ' HB3' ' A' ' 11' ' ' ARG . 8.4 ptp180 . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.788 0.804 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.404 ' HA ' ' HZ2' ' A' ' 23' ' ' LYS . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HZ2' ' HA ' ' A' ' 20' ' ' THR . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.457 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 . . . . . 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 20' ' ' THR . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' THR . . . . . 0.403 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.457 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 . . . . . 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.173 0.511 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.414 ' CB ' HD21 ' A' ' 17' ' ' ASN . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.414 HD21 ' CB ' ' A' ' 12' ' ' SER . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' HD11 ' A' ' 18' ' ' LEU . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.416 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 . . . . . 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.586 0.232 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.881 0.372 . . . . 0.0 111.884 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.44 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.323 0.583 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.432 ' ND1' ' HG3' ' A' ' 25' ' ' LYS . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HG3' ' ND1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 52.3 mm-40 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 . . . . . 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 110.839 -0.06 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 25' ' ' LYS . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 24' ' ' THR . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HD2' ' N ' ' A' ' 12' ' ' SER . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 . . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 73.8 m-70 . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.464 ' NE2' ' HA ' ' A' ' 9' ' ' GLU 0.262 2.9 tm0? -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 122.165 0.984 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.421 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.891 0.377 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 16.4 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.243 0.544 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 . . . . . 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 44.0 mm-40 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 87.6 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 . . . . . 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.483 0.659 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 15' ' ' SER . . . . . 0.484 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 N--CA 1.488 1.449 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' CE1' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 . . . . . 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.401 ' CE1' ' HB2' ' A' ' 7' ' ' TYR . 30.3 m170 . . . . . 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.2 p -113.61 177.94 4.46 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -114.88 134.53 55.07 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 2.5 pp0? -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.441 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -116.64 57.3 0.78 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.418 HD23 ' CE1' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -132.35 129.2 39.13 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.763 0.665 . . . . 0.0 112.302 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CE1' HD23 ' A' ' 10' ' ' ALC . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -122.83 -40.23 2.45 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 m 43.49 44.33 4.98 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 113.202 -1.817 . . . . 0.0 113.235 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -128.05 -38.58 1.81 Allowed 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.74 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -121.41 166.77 13.62 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.589 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? . . . . . 0 N--CA 1.502 2.142 0 O-C-N 120.428 -1.42 . . . . 0.0 108.548 -0.035 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 tttm . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 45.9 p -102.04 173.05 6.56 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.156 0.91 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -126.16 160.18 30.89 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.686 -1.597 . . . . 0.0 106.967 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -116.57 60.22 0.74 Allowed 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.524 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.5 ttp-105 -126.38 127.25 45.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.124 0.89 . . . . 0.0 108.785 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 31.7 m120 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 10' ' ' ALC . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -101.8 -41.33 6.56 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 t -120.8 -170.03 1.93 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 103.417 -2.808 . . . . 0.0 103.417 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 ttmp? -121.76 -59.29 1.69 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -131.12 82.09 2.03 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 126.117 2.136 . . . . 0.0 109.031 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.417 1.103 . . . . 0.0 108.876 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 119.639 -0.219 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 35.7 p -124.12 159.45 29.98 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.801 0.81 . . . . 0.0 111.899 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -128.82 151.46 49.57 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 112.96 -1.927 . . . . 0.0 107.488 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.3 mm-40 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -116.82 57.12 0.79 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.562 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -123.39 151.94 42.06 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.93 -1.508 . . . . 0.0 112.739 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' CE1' HD23 ' A' ' 10' ' ' ALC . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' C ' ' H ' ' A' ' 27' ' ' SER . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -98.2 24.14 7.5 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.425 ' H ' ' C ' ' A' ' 25' ' ' LYS . 53.3 m 3.46 -113.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.401 ' O ' ' C ' ' A' ' 29' ' ' GLU . 14.7 ptpt -119.21 -18.8 8.57 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.913 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -15.55 -58.03 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 126.442 2.339 . . . . 0.0 110.102 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.3 tttm . . . . . 0 N--CA 1.488 1.463 0 CA-C-N 112.568 -2.106 . . . . 0.0 106.857 179.555 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.5 tttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.151 0.501 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.2 t -120.49 175.22 6.09 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 114.01 -1.45 . . . . 0.0 113.327 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -107.63 98.09 7.74 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 7.0 tp-100 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -114.92 57.74 0.72 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.533 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 -124.13 101.85 7.42 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.592 1.183 . . . . 0.0 112.0 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.0 m-20 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' CG ' HD13 ' A' ' 10' ' ' ALC . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 -119.95 -52.09 2.22 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.4 t -12.11 86.54 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 N-CA-C 116.46 2.022 . . . . 0.0 116.46 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.65 -178.02 0.08 Allowed 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -113.39 -38.38 4.4 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.43 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.702 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.431 ' HG3' ' N ' ' A' ' 2' ' ' THR . 20.6 pttp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.431 ' N ' ' HG3' ' A' ' 1' ' ' LYS . 24.2 m -113.24 168.35 9.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.212 0.945 . . . . 0.0 108.86 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -123.84 117.21 24.36 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.695 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.3 pp0? -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 27.8 mm100 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.446 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -115.77 57.53 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.534 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.434 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.6 mmt180 -126.08 133.45 51.67 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.405 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.447 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -114.15 -42.39 3.36 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 p 33.11 -74.67 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -120.91 93.28 3.98 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -120.09 74.86 1.06 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 123.634 0.584 . . . . 0.0 111.062 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.135 -2.228 . . . . 0.0 110.164 0.194 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.5 p -128.33 175.16 8.7 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.603 1.19 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -112.55 162.27 15.83 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -109.69 58.18 0.61 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.577 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -121.15 129.56 53.31 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.009 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -111.33 5.25 19.65 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.1 t -127.12 153.38 46.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 105.065 -2.198 . . . . 0.0 105.065 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 38.34 3.81 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -112.5 -63.41 1.44 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 106.692 -1.595 . . . . 0.0 106.692 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.6 tttm . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 122.383 1.087 . . . . 0.0 109.041 179.845 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mttm . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.6 p -120.11 175.69 5.81 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.796 1.284 . . . . 0.0 114.237 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -119.97 172.24 7.87 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.253 -2.703 . . . . 0.0 107.019 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.7 mm-40 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.631 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -112.77 55.69 0.69 Allowed 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.631 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.446 ' N ' ' HD3' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -130.32 149.51 51.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.588 1.18 . . . . 0.0 110.295 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.445 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' HD13 ' A' ' 10' ' ' ALC . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 -111.74 -30.56 7.27 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.1 m 22.8 97.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -100.27 154.41 18.49 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.353 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -132.14 -60.65 0.9 Allowed 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.773 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.498 1.959 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.319 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.2 p -115.93 171.92 7.48 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.228 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -120.19 154.51 34.71 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.474 -1.239 . . . . 0.0 107.822 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.469 ' NE2' ' HE ' ' A' ' 11' ' ' ARG . 2.8 tp-100 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.93 59.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.572 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.469 ' HE ' ' NE2' ' A' ' 4' ' ' GLN . 9.9 mmt180 -113.79 128.21 56.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.298 0.999 . . . . 0.0 113.15 -179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.402 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -123.27 -57.27 1.69 Allowed 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -40.32 -48.9 2.73 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -116.36 -41.43 3.12 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.188 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 30' ' ' LYS . 36.8 tt0 -109.95 177.11 4.82 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.642 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' N ' ' HG2' ' A' ' 29' ' ' GLU . 24.0 pttm . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 122.581 1.181 . . . . 0.0 109.854 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.1 m 104.17 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 O-C-N 126.271 2.232 . . . . 0.0 105.627 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -126.49 147.0 49.89 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.109 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -115.92 55.32 0.8 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.477 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -122.79 143.47 49.81 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -109.12 -50.28 3.02 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.3 p -17.26 -71.02 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.6 ttmt -124.59 -65.24 1.05 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.262 0.976 . . . . 0.0 113.401 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 21.67 91.53 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 125.406 1.691 . . . . 0.0 114.707 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 122.571 1.177 . . . . 0.0 109.569 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 91.5 mttt . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.3 p -120.24 -174.75 2.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.537 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -110.03 140.88 43.58 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -108.7 52.77 0.7 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.571 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -122.74 132.14 54.1 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.285 0.991 . . . . 0.0 112.805 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -79.33 -50.97 10.04 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 t -4.18 90.88 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 O-C-N 125.784 1.928 . . . . 0.0 114.354 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -108.84 170.61 7.93 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.101 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -113.69 152.55 30.32 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.162 0.914 . . . . 0.0 110.098 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 N--CA 1.496 1.838 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.93 -179.981 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.017 0.437 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.4 p -128.69 171.87 11.78 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.439 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -128.93 139.46 52.11 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -112.01 53.64 0.72 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.533 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.579 ' HD3' ' H ' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -129.98 133.15 46.6 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.645 0.591 . . . . 0.0 110.45 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.618 ' H ' HD21 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.618 HD21 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.461 ' CG ' HD13 ' A' ' 10' ' ' ALC . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -112.71 -38.85 4.46 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 t -106.14 -168.33 1.42 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -119.44 163.72 16.82 Favored 'General case' 0 N--CA 1.503 2.185 0 CA-C-O 121.12 0.486 . . . . 0.0 112.093 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.94 -175.77 3.65 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' HZ1' ' H ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 20.4 m -91.72 166.86 12.56 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -122.77 150.69 42.45 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.835 0.709 . . . . 0.0 109.374 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.423 HE21 ' C ' ' A' ' 9' ' ' GLU . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' C ' HE21 ' A' ' 4' ' ' GLN . 49.2 tp10 -113.97 59.0 0.67 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.507 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -122.31 137.72 54.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.959 0.787 . . . . 0.0 112.431 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.447 ' CE1' HD23 ' A' ' 10' ' ' ALC . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -109.57 -39.75 5.06 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.5 p 17.4 59.54 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 125.731 1.894 . . . . 0.0 114.441 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -110.68 -35.64 5.94 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 112.75 -2.023 . . . . 0.0 106.096 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.447 ' CD ' ' H ' ' A' ' 29' ' ' GLU . 0.9 OUTLIER -113.23 135.0 54.31 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 113.277 -1.783 . . . . 0.0 106.969 179.734 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt . . . . . 0 N--CA 1.496 1.873 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.962 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 tttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.0 t -120.04 170.28 9.43 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 122.624 1.202 . . . . 0.0 109.966 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -121.46 131.97 54.46 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 111.473 -2.603 . . . . 0.0 104.249 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -116.47 56.1 0.8 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.491 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.78 131.17 56.89 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 124.402 1.063 . . . . 0.0 113.237 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 31.8 m120 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -111.08 -61.89 1.62 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 m 64.4 -72.43 0.06 Allowed 'General case' 0 N--CA 1.507 2.399 0 O-C-N 125.837 1.961 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -115.5 -179.51 3.66 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 104.193 -2.521 . . . . 0.0 104.193 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -122.93 160.74 25.56 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.896 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt . . . . . 0 N--CA 1.498 1.945 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.906 179.936 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 85.5 tttt . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.6 p -107.22 170.54 7.89 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.035 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 -120.74 156.0 32.74 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.954 -1.93 . . . . 0.0 105.863 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.649 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -111.48 56.34 0.65 Allowed 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.649 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -142.57 152.65 42.79 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.496 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 19' ' ' LYS . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' HD1' ' HD2' ' A' ' 25' ' ' LYS . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 21' ' ' HIS . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -112.83 -41.36 3.8 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.7 p -106.13 144.97 32.08 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 125.156 1.535 . . . . 0.0 111.196 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -114.44 177.92 4.47 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 111.113 -2.767 . . . . 0.0 105.666 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -109.66 53.09 0.7 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.022 0.915 . . . . 0.0 109.317 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt . . . . . 0 N--CA 1.505 2.315 0 CA-C-N 112.267 -2.242 . . . . 0.0 116.133 179.876 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 t -118.1 170.4 8.89 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.148 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -131.31 155.13 47.72 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 112.727 -2.033 . . . . 0.0 109.642 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -121.61 61.66 0.93 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.554 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -101.55 129.06 47.56 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 124.243 0.965 . . . . 0.0 112.095 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.516 ' HD1' ' HZ3' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HZ3' ' HD1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -114.96 -48.55 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.4 m 112.28 169.41 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 127.267 2.855 . . . . 0.0 104.086 -179.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -122.13 -58.02 1.74 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -126.36 -51.78 1.51 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.624 -2.08 . . . . 0.0 107.066 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 tttp . . . . . 0 N--CA 1.494 1.755 0 CA-C-N 113.63 -1.623 . . . . 0.0 108.648 -179.934 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.834 0.349 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.9 m -108.16 167.44 10.01 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -130.78 148.46 52.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.417 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -112.85 59.49 0.64 Allowed 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.611 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.75 141.79 51.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 124.236 0.96 . . . . 0.0 109.616 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -119.21 -42.41 2.68 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -106.43 -168.74 1.46 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.928 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -106.03 103.07 12.47 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.382 -1.735 . . . . 0.0 108.143 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.84 152.92 0.68 Allowed 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.592 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 122.141 0.972 . . . . 0.0 109.125 -179.998 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 47.5 p -111.67 -173.78 2.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -113.54 89.3 3.05 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 82.0 mm-40 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.502 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -115.64 56.15 0.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.597 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.428 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 13.1 ttm180 -122.69 141.35 51.86 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.445 ' HA ' ' HZ3' ' A' ' 23' ' ' LYS . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.515 ' CG ' HD13 ' A' ' 10' ' ' ALC . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 20' ' ' THR . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -100.9 -55.44 2.57 Favored 'General case' 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.4 p -131.26 161.35 32.47 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -121.68 -71.33 0.74 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.793 1.637 . . . . 0.0 108.256 -0.174 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -129.85 -50.99 1.14 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 114.473 -1.24 . . . . 0.0 109.261 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 122.549 1.166 . . . . 0.0 110.465 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.1 p -117.21 155.12 29.95 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.625 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -125.39 148.09 48.92 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 112.847 -1.979 . . . . 0.0 106.457 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.458 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -118.31 57.34 0.85 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.448 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -122.47 149.42 43.9 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 25' ' ' LYS . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.458 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 -117.18 -43.53 2.84 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.1 t -114.5 -179.98 3.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 124.648 1.218 . . . . 0.0 111.344 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.429 ' NZ ' ' HB2' ' A' ' 28' ' ' LYS . 4.6 ttmp? -19.97 108.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 112.572 -2.103 . . . . 0.0 114.82 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 7.0 pt-20 -151.5 168.86 23.56 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 125.364 1.465 . . . . 0.0 111.481 -0.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 N--CA 1.507 2.396 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.2 p -103.75 166.71 10.25 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 -125.02 177.02 6.29 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 111.976 -2.374 . . . . 0.0 109.325 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -113.05 55.94 0.69 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.546 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -131.35 152.89 50.19 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.997 -0.681 . . . . 0.0 111.843 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 49.7 t-20 -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 18' ' ' LEU . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.401 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 82.4 m-70 -97.95 24.1 7.34 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.2 p -130.99 -173.65 3.16 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -120.89 50.77 1.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -113.41 -141.89 0.38 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.499 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 pttm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 121.514 0.673 . . . . 0.0 109.404 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.919 0.39 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 6.5 t -121.44 172.09 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.27 1.033 . . . . 0.0 112.007 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -134.83 167.57 20.63 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 111.55 -2.568 . . . . 0.0 106.694 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -113.22 55.38 0.71 Allowed 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.588 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -118.64 153.36 34.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 124.638 1.212 . . . . 0.0 108.162 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.47 ' CG ' HD13 ' A' ' 10' ' ' ALC . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HZ2' ' HD1' ' A' ' 21' ' ' HIS . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.406 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 64.9 m-70 -118.84 -39.58 2.95 Favored 'General case' 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t 26.89 60.02 0.08 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -117.08 167.8 10.84 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 30' ' ' LYS . 9.5 mp0 -109.86 113.37 26.06 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.474 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' GLU . 18.6 ttmm . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 121.903 2.138 . . . . 0.0 108.545 0.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.6 p -132.06 173.75 10.9 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.292 0.995 . . . . 0.0 111.951 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.95 152.31 34.84 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 179.529 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.2 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -115.59 57.61 0.74 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.504 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.426 HH11 ' HB3' ' A' ' 11' ' ' ARG . 8.4 ptp180 -117.24 112.81 21.3 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 113.261 -1.79 . . . . 0.0 109.062 -179.713 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.404 ' HA ' ' HZ2' ' A' ' 23' ' ' LYS . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.504 ' CG ' HD13 ' A' ' 10' ' ' ALC . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HZ2' ' HA ' ' A' ' 20' ' ' THR . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -109.83 -37.03 5.75 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.1 p 33.96 40.01 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 126.035 2.084 . . . . 0.0 113.438 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' NZ ' ' HB2' ' A' ' 28' ' ' LYS . 3.9 ttmp? -126.22 48.64 2.09 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 102.527 -3.138 . . . . 0.0 102.527 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -132.71 71.85 1.48 Allowed 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 112.259 -2.246 . . . . 0.0 105.306 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 N--CA 1.499 1.988 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.675 -179.734 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.1 m 100.53 165.86 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 126.154 2.159 . . . . 0.0 105.381 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -121.86 88.43 2.93 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.457 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -113.51 55.48 0.71 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.501 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 -122.26 112.24 17.91 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 20' ' ' THR . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.403 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.501 ' CG ' HD13 ' A' ' 10' ' ' ALC . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.457 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 -123.12 -38.11 2.63 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.9 m -97.33 -64.76 1.01 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.352 1.033 . . . . 0.0 113.398 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -119.19 153.69 34.53 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.313 1.008 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.56 -43.5 5.87 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 104.596 -2.372 . . . . 0.0 104.596 -0.042 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 mttp . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 m 61.68 162.95 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.299 -2.228 . . . . 0.0 112.272 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -133.37 138.93 46.52 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 113.453 -1.703 . . . . 0.0 109.233 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -121.84 55.18 1.12 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.455 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -111.93 116.7 31.05 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.288 0.992 . . . . 0.0 110.817 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.455 ' CG ' HD13 ' A' ' 10' ' ' ALC . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -124.62 -48.7 1.79 Allowed 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.9 m -110.83 66.05 0.62 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.926 -1.488 . . . . 0.0 111.087 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.549 ' H ' ' HD3' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -119.14 -48.7 2.42 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.311 -1.768 . . . . 0.0 107.368 179.943 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.517 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 69.3 mm-40 -128.14 162.83 26.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.208 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 122.428 1.109 . . . . 0.0 109.335 179.822 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.4 p -108.43 158.66 17.33 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 122.11 0.957 . . . . 0.0 112.148 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -126.66 149.19 49.66 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 112.423 -2.171 . . . . 0.0 108.262 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.4 mm-40 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.518 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -117.1 59.55 0.76 Allowed 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.518 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 -114.93 129.38 56.7 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.414 ' CB ' HD21 ' A' ' 17' ' ' ASN . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.414 HD21 ' CB ' ' A' ' 12' ' ' SER . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.544 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.404 ' CG ' HD13 ' A' ' 10' ' ' ALC . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 27' ' ' SER . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -110.27 -40.9 4.54 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 23.2 t -87.22 94.52 9.68 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.812 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -110.47 -164.48 0.93 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 113.768 -1.56 . . . . 0.0 109.086 179.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.07 45.31 1.12 Allowed 'General case' 0 N--CA 1.503 2.209 0 CA-C-O 121.647 0.737 . . . . 0.0 112.304 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 122.418 1.104 . . . . 0.0 109.862 179.507 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.7 mttm . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.417 HG22 ' N ' ' A' ' 3' ' ' TYR . 77.1 m -131.91 167.64 19.27 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.746 0.784 . . . . 0.0 109.178 179.943 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.417 ' N ' HG22 ' A' ' 2' ' ' THR . 13.3 m-85 -124.87 96.32 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' HD11 ' A' ' 18' ' ' LEU . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.62 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -119.14 59.88 0.83 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.62 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -110.72 132.2 54.4 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 30.0 p-10 -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.416 HD11 ' HA ' ' A' ' 5' ' ' CYS . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -112.6 -44.52 3.33 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.6 m 45.91 24.75 0.25 Allowed 'General case' 0 N--CA 1.502 2.127 0 CA-C-N 113.914 -1.494 . . . . 0.0 114.292 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -124.51 47.78 2.05 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 179.691 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -10.13 -60.63 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 112.379 -2.192 . . . . 0.0 115.755 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 124.65 1.219 . . . . 0.0 111.369 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t -122.77 176.51 5.93 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.564 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -140.46 165.63 26.92 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 111.908 -2.405 . . . . 0.0 110.509 -179.762 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -114.98 55.62 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.644 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -124.16 157.47 34.61 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.262 -0.975 . . . . 0.0 111.884 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -107.42 -43.6 4.51 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.2 p -124.25 172.88 8.73 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 102.602 -3.11 . . . . 0.0 102.602 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -134.63 71.82 1.45 Allowed 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 -0.153 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -96.35 160.08 14.61 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.047 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.496 1.847 0 CA-C-N 113.525 -1.671 . . . . 0.0 110.255 -179.772 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.107 0.479 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -134.45 178.01 7.32 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.928 179.762 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -120.91 162.03 20.56 Favored 'General case' 0 N--CA 1.5 2.074 0 CA-C-N 114.625 -1.17 . . . . 0.0 107.938 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.412 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 7.9 tp-100 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.44 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -115.21 57.46 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.622 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -117.76 143.1 46.54 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 124.827 1.33 . . . . 0.0 109.67 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 10' ' ' ALC . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -111.87 -38.48 4.82 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 61.1 p -113.85 56.04 0.71 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 124.781 1.301 . . . . 0.0 112.274 -179.901 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 27' ' ' SER . 62.4 tttp 112.14 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 C-N-CA 127.112 2.165 . . . . 0.0 108.623 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -128.33 -66.17 0.86 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.6 ' H ' ' HD3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.265 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 58.9 m -136.0 171.16 14.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.705 0.628 . . . . 0.0 109.525 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -119.23 139.79 51.3 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.572 179.714 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.3 tp-100 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.401 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 52.3 mm-40 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 3.4 tp10 -116.93 54.07 0.88 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.507 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.47 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 7.8 mmt85 -120.82 124.51 45.23 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.839 -179.647 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 t-20 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.507 ' CG ' HD13 ' A' ' 10' ' ' ALC . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 25' ' ' LYS . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 24' ' ' THR . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -122.9 -48.94 1.99 Allowed 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -126.32 80.07 1.9 Allowed 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.398 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -28.36 88.16 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.54 0 O-C-N 124.832 1.332 . . . . 0.0 113.725 179.507 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 5.35 146.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 121.064 3.728 . . . . 0.0 121.064 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.163 0 O-C-N 119.452 -2.03 . . . . 0.0 110.478 0.181 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 3' ' ' TYR . 18.2 m -123.7 177.69 5.58 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 114.517 -1.219 . . . . 0.0 108.815 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.463 ' H ' HG22 ' A' ' 2' ' ' THR . 96.3 m-85 -118.56 131.23 56.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.764 0.665 . . . . 0.0 110.444 -179.938 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -120.79 62.1 0.88 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.495 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.461 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 0.8 OUTLIER -123.48 130.71 53.09 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 179.876 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 73.8 m-70 -108.14 -55.68 2.34 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -14.5 70.15 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 O-C-N 125.906 2.004 . . . . 0.0 116.091 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' HIS . 14.0 mptt 48.57 54.08 11.13 Favored 'General case' 0 N--CA 1.504 2.275 0 CA-C-O 122.936 1.351 . . . . 0.0 109.671 -179.468 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -114.95 -66.66 1.06 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.475 -2.148 . . . . 0.0 108.51 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.306 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -98.62 172.67 7.34 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 -121.06 133.57 55.24 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.767 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.464 ' NE2' ' HA ' ' A' ' 9' ' ' GLU 0.262 2.9 tm0? -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 -113.18 -43.82 3.33 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.548 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.418 ' H ' ' HG2' ' A' ' 11' ' ' ARG . 1.2 ptm180 -100.78 123.98 45.76 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 113.781 -1.554 . . . . 0.0 113.14 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 10' ' ' ALC . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 27' ' ' SER . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -100.16 43.38 1.06 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 44.4 t -126.37 59.16 1.35 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 113.505 -1.68 . . . . 0.0 107.477 179.631 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -123.32 61.44 1.04 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.305 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -120.85 -34.88 3.46 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 113.481 -1.691 . . . . 0.0 109.189 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.4 tptt . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 122.544 1.164 . . . . 0.0 108.153 -179.991 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.4 p -112.18 176.98 4.8 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.988 0.899 . . . . 0.0 109.244 179.859 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -110.23 132.87 53.79 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 112.929 -1.942 . . . . 0.0 105.76 179.898 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -124.64 58.09 1.24 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.428 ' HG ' ' H ' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.428 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 8.0 tpp85 -118.73 126.46 51.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 124.152 0.908 . . . . 0.0 110.737 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CG ' HD13 ' A' ' 10' ' ' ALC . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -122.4 -38.12 2.71 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.6 m -108.74 46.55 0.96 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.96 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -9.2 124.04 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 117.072 2.249 . . . . 0.0 117.072 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.564 ' H ' ' HA ' ' A' ' 30' ' ' LYS . 4.7 mm-40 -112.59 -53.75 2.68 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.35 -1.295 . . . . 0.0 110.863 -179.988 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.147 0 CA-C-N 121.95 2.159 . . . . 0.0 111.19 -0.191 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.436 ' HD2' ' N ' ' A' ' 1' ' ' LYS . 1.5 mptp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.1 174.14 6.14 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 120.509 1.504 . . . . 0.0 109.39 0.043 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -118.33 141.51 48.46 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 179.861 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 16.4 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -114.01 55.54 0.73 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.501 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.475 ' HD3' ' C ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -119.87 130.19 54.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.125 0.891 . . . . 0.0 109.872 179.727 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.501 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.407 ' O ' ' CB ' ' A' ' 27' ' ' SER . 78.1 m-70 -111.57 -46.0 3.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 26' ' ' HIS . 86.9 p 119.13 -177.26 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 126.807 2.567 . . . . 0.0 108.786 179.923 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.4 mttp 95.07 161.07 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 126.552 2.408 . . . . 0.0 112.164 179.515 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.05 21.75 8.07 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 113.635 -1.62 . . . . 0.0 109.184 179.974 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.496 1.869 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.181 179.99 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.623 ' H2 ' ' HA ' ' A' ' 2' ' ' THR . 18.5 pttm . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.623 ' HA ' ' H2 ' ' A' ' 1' ' ' LYS . 33.5 p -112.79 160.54 17.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 119.646 -1.909 . . . . 0.0 110.36 -0.055 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -120.87 151.45 39.63 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.755 -1.566 . . . . 0.0 106.858 179.661 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 44.0 mm-40 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 87.6 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -118.97 61.39 0.8 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.472 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -110.03 128.59 55.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 124.419 1.074 . . . . 0.0 111.05 -179.658 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.484 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.4 t30 -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.408 ' CG ' HD13 ' A' ' 10' ' ' ALC . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -107.33 -55.39 2.35 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.9 p 5.5 -76.46 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 O-C-N 125.515 1.76 . . . . 0.0 115.496 -179.662 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -32.66 -41.82 0.07 Allowed 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 179.599 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 6.71 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.502 0 O-C-N 125.717 1.885 . . . . 0.0 113.955 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 113.437 -1.711 . . . . 0.0 115.514 -179.866 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 m -113.38 163.37 14.94 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.9 0.857 . . . . 0.0 109.643 -179.912 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -136.1 92.12 2.76 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.323 -1.762 . . . . 0.0 108.859 -179.895 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.456 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.425 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -108.67 52.33 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ALC . . . . . 0.429 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -123.69 115.02 20.75 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.44 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD13 ' A' ' 10' ' ' ALC . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.456 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 45.7 m-70 -119.73 -28.67 5.2 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 57.8 p 24.31 76.61 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 179.644 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -7.2 -77.71 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.674 2.101 . . . . 0.0 116.674 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -128.98 53.5 1.87 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.306 1.004 . . . . 0.0 111.245 -179.885 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.4 mttm . . . . . 0 N--CA 1.51 2.536 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 179.641 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.441 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 . . . . . 0 N--CA 1.499 1.999 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 . . . . . 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 . . . . . 0 N--CA 1.494 1.764 0 N-CA-C 106.967 -1.494 . . . . 0.0 106.967 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.5 ttp-105 . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.434 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 . . . . . 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 . . . . . 0 N--CA 1.497 1.883 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 . . . . . 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 122.584 1.183 . . . . 0.0 112.739 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 . . . . . 0 N--CA 1.487 1.41 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 32.4 tp60 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 . . . . . 0 N--CA 1.495 1.779 0 CA-C-O 121.304 0.573 . . . . 0.0 112.0 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.7 m120 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 . . . . . 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 . . . . . 0 N--CA 1.494 1.739 0 CA-C-O 118.996 -0.526 . . . . 0.0 110.695 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.446 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 . . . . . 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 39.6 mmt180 . . . . . 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.405 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.306 0.574 . . . . 0.0 111.009 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 . . . . . 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 . . . . . 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.446 ' HD3' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 120.88 0.371 . . . . 0.0 110.295 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.445 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 . . . . . 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 . . . . . 0 N--CA 1.5 2.05 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 . . . . . 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.913 0.864 . . . . 0.0 113.15 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.53 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.489 ' H ' HD22 ' A' ' 17' ' ' ASN . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 . . . . . 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 120.82 0.343 . . . . 0.0 111.109 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 . . . . . 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 . . . . . 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 . . . . . 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 . . . . . 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 121.568 0.699 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 . . . . . 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 . . . . . 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 . . . . . 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.421 ' HD3' ' N ' ' A' ' 11' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 CA-C-O 121.152 0.501 . . . . 0.0 110.45 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.618 ' H ' HD21 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.618 HD21 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 . . . . . 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 . . . . . 0 N--CA 1.497 1.915 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.423 HE21 ' C ' ' A' ' 9' ' ' GLU . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.423 ' C ' HE21 ' A' ' 4' ' ' GLN . 49.2 tp10 . . . . . 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 121.26 0.552 . . . . 0.0 112.431 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 . . . . . 0 N--CA 1.491 1.61 0 N-CA-C 104.249 -2.5 . . . . 0.0 104.249 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 121.994 0.902 . . . . 0.0 113.237 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 . . . . . 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 . . . . . 0 N--CA 1.493 1.718 0 N-CA-C 105.863 -1.902 . . . . 0.0 105.863 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.433 HE22 ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.433 ' HA ' HE22 ' A' ' 4' ' ' GLN . 32.7 tt0 . . . . . 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 . . . . . 0 N--CA 1.485 1.313 0 CA-C-O 122.081 0.943 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 19' ' ' LYS . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 . . . . . 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 . . . . . 0 N--CA 1.497 1.896 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 . . . . . 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 . . . . . 0 N--CA 1.496 1.864 0 CA-C-O 121.617 0.723 . . . . 0.0 112.095 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.436 ' CE1' ' HD2' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.436 ' HD2' ' CE1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 . . . . . 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 . . . . . 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.417 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 . . . . . 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.507 0 CA-C-O 121.576 0.703 . . . . 0.0 109.616 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 18.6 mm100 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.502 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.1 ttm180 . . . . . 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.445 ' HA ' ' HZ3' ' A' ' 23' ' ' LYS . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 20' ' ' THR . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 . . . . . 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 . . . . . 0 N--CA 1.498 1.949 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 4' ' ' GLN . 0.8 OUTLIER -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.458 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 . . . . . 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 25' ' ' LYS . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.458 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 . . . . . 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 . . . . . 0 N--CA 1.498 1.933 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 . . . . . 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.392 0.615 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 18' ' ' LEU . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.401 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 82.4 m-70 . . . . . 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 . . . . . 0 N--CA 1.488 1.455 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 . . . . . 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.406 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 64.9 m-70 . . . . . 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 . . . . . 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 69.6 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 . . . . . 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.426 HH11 ' HB3' ' A' ' 11' ' ' ARG . 8.4 ptp180 . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.788 0.804 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.404 ' HA ' ' HZ2' ' A' ' 23' ' ' LYS . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HZ2' ' HA ' ' A' ' 20' ' ' THR . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.418 HE22 ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.457 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HA ' HE22 ' A' ' 4' ' ' GLN . 20.2 tt0 . . . . . 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 . . . . . 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 20' ' ' THR . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . 0.403 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.457 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 . . . . . 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 . . . . . 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 . . . . . 0 N--CA 1.495 1.781 0 CA-C-O 121.173 0.511 . . . . 0.0 110.817 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 . . . . . 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 108.262 -1.014 . . . . 0.0 108.262 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.414 ' CB ' HD21 ' A' ' 17' ' ' ASN . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.414 HD21 ' CB ' ' A' ' 12' ' ' SER . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 . . . . . 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' HD11 ' A' ' 18' ' ' LEU . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 . . . . . 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 . . . . . 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.533 ' H ' HD21 ' A' ' 17' ' ' ASN . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.533 HD21 ' H ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 17' ' ' ASN . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 . . . . . 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 . . . . . 0 N--CA 1.492 1.662 0 CA-C-O 120.586 0.232 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 . . . . . 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 120.881 0.372 . . . . 0.0 111.884 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 . . . . . 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.1 tp60 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.44 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.323 0.583 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.432 ' ND1' ' HG3' ' A' ' 25' ' ' LYS . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.432 ' HG3' ' ND1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 . . . . . 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 . . . . . 0 N--CA 1.499 2.015 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.456 ' NE2' ' HA ' ' A' ' 9' ' ' GLU . 36.1 tp60 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.424 ' N ' ' NE2' ' A' ' 4' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 mm100 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.456 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 3.4 tp10 . . . . . 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 . . . . . 0 N--CA 1.495 1.801 0 N-CA-C 110.839 -0.06 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 25' ' ' LYS . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 24' ' ' THR . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.3 m-85 . . . . . 0 N--CA 1.497 1.902 0 N-CA-C 110.444 -0.206 . . . . 0.0 110.444 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 . . . . . 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.439 ' HD2' ' N ' ' A' ' 12' ' ' SER . 0.8 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 73.8 m-70 . . . . . 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 . . . . . 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.413 HE21 ' C ' ' A' ' 4' ' ' GLN 0.262 0.0 OUTLIER -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 . . . . . 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 . . . . . 0 N--CA 1.497 1.875 0 CA-C-O 122.165 0.984 . . . . 0.0 113.14 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.421 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 . . . . . 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 . . . . . 0 N--CA 1.483 1.217 0 N-CA-C 105.76 -1.941 . . . . 0.0 105.76 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 . . . . . 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.0 tpp85 . . . . . 0 N--CA 1.494 1.76 0 CA-C-O 120.891 0.377 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 . . . . . 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 . . . . . 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.8 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 . . . . . 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.714 0 CA-C-O 121.243 0.544 . . . . 0.0 109.872 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 78.1 m-70 . . . . . 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 106.858 -1.534 . . . . 0.0 106.858 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.9 mm100 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 27.3 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 . . . . . 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 . . . . . 0 N--CA 1.495 1.776 0 CA-C-O 121.483 0.659 . . . . 0.0 111.05 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . 0.484 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 . . . . . 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 . . . . . 0 N--CA 1.488 1.449 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.456 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 . . . . . 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 . . . . . 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.402 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.456 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 45.7 m-70 . . . . . 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.6 mttt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.2 p -113.61 177.94 4.46 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-N 114.781 -1.1 . . . . 0.0 110.847 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 3.4 m-85 -114.88 134.53 55.07 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 102.557 -3.127 . . . . 0.0 102.557 179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -117.82 137.95 52.41 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.18 -1.785 . . . . 0.0 106.18 179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.6 t -35.2 144.84 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 115.025 1.491 . . . . 0.0 115.025 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.441 ' HG3' ' CE2' ' A' ' 7' ' ' TYR . 15.7 pt20 -99.56 30.45 3.59 Favored 'General case' 0 N--CA 1.501 2.105 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.221 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.441 ' CE2' ' HG3' ' A' ' 6' ' ' GLN . 52.1 m-85 -140.5 -50.36 0.46 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-N 113.832 -1.531 . . . . 0.0 108.821 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 14.6 p -117.53 -159.98 0.76 Allowed 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 107.029 -1.471 . . . . 0.0 107.029 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -116.64 57.3 0.78 Allowed 'General case' 0 N--CA 1.491 1.609 0 CA-C-O 121.743 0.782 . . . . 0.0 110.853 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.418 HD23 ' CE1' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 30.4 mtp180 -132.35 129.2 39.13 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 123.763 0.665 . . . . 0.0 112.302 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 51.1 m -131.51 167.13 19.89 Favored 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 115.131 -0.94 . . . . 0.0 109.227 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -112.11 -9.02 13.98 Favored 'General case' 0 N--CA 1.501 2.12 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.84 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -125.1 173.53 8.66 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 124.48 1.112 . . . . 0.0 109.489 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.4 t -95.88 -60.38 1.65 Allowed 'General case' 0 N--CA 1.498 1.971 0 CA-C-O 118.578 -0.725 . . . . 0.0 109.518 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.9 t -39.66 -50.65 2.3 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-O 122.508 1.147 . . . . 0.0 108.797 179.516 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -50.47 -56.7 10.38 Favored 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 113.083 -1.871 . . . . 0.0 112.655 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.94 -40.85 94.84 Favored 'General case' 0 N--CA 1.497 1.918 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.542 -179.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp -59.06 -50.26 74.74 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 179.678 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 92.8 m -48.51 -56.92 7.0 Favored 'General case' 0 N--CA 1.501 2.086 0 N-CA-C 106.622 -1.622 . . . . 0.0 106.622 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.418 ' CE1' HD23 ' A' ' 10' ' ' ALC . 18.5 t60 -43.39 -58.08 2.74 Favored 'General case' 0 N--CA 1.496 1.856 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.18 179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 89.9 mt -50.59 -58.71 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 O-C-N 123.546 0.529 . . . . 0.0 111.064 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.2 ttmm -35.48 -42.43 0.22 Allowed 'General case' 0 N--CA 1.508 2.434 0 N-CA-C 115.165 1.543 . . . . 0.0 115.165 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.3 t -102.42 -33.03 9.7 Favored 'General case' 0 N--CA 1.502 2.139 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 -179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.0 mmtp -89.47 -17.13 29.29 Favored 'General case' 0 N--CA 1.503 2.196 0 N-CA-C 114.116 1.154 . . . . 0.0 114.116 -179.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.8 m-70 -122.83 -40.23 2.45 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-O 121.497 0.665 . . . . 0.0 110.873 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 m 43.49 44.33 4.98 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-N 113.202 -1.817 . . . . 0.0 113.235 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -128.05 -38.58 1.81 Allowed 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.958 -1.019 . . . . 0.0 109.74 179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -121.41 166.77 13.62 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.589 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? . . . . . 0 N--CA 1.502 2.142 0 O-C-N 120.428 -1.42 . . . . 0.0 108.548 -0.035 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 64.1 tttm . . . . . 0 N--CA 1.491 1.601 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 45.9 p -102.04 173.05 6.56 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 124.156 0.91 . . . . 0.0 110.894 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -126.16 160.18 30.89 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-N 113.686 -1.597 . . . . 0.0 106.967 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -121.47 -170.94 2.12 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.926 -0.71 . . . . 0.0 111.318 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.8 t -95.05 164.84 12.71 Favored 'General case' 0 N--CA 1.506 2.361 0 C-N-CA 119.566 -0.854 . . . . 0.0 111.152 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 15.6 mp0 -108.27 10.95 27.63 Favored 'General case' 0 N--CA 1.505 2.325 0 O-C-N 124.754 1.284 . . . . 0.0 111.57 -179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -121.37 -48.15 2.21 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 105.273 -2.121 . . . . 0.0 105.273 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 16.4 p -122.74 -163.74 1.12 Allowed 'General case' 0 N--CA 1.492 1.641 0 CA-C-N 113.745 -1.571 . . . . 0.0 107.762 179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -116.57 60.22 0.74 Allowed 'General case' 0 C--N 1.306 -1.291 0 CA-C-N 114.031 -1.441 . . . . 0.0 107.837 179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.524 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.414 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.5 ttp-105 -126.38 127.25 45.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.124 0.89 . . . . 0.0 108.785 179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -135.98 169.95 16.78 Favored 'General case' 0 N--CA 1.498 1.957 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.68 -20.13 14.51 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 120.413 -0.515 . . . . 0.0 110.381 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -120.1 178.37 4.65 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 124.403 1.064 . . . . 0.0 110.548 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 t -109.56 -49.23 3.13 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.0 t -43.11 -49.77 6.26 Favored 'General case' 0 N--CA 1.511 2.596 0 CA-C-O 123.753 1.739 . . . . 0.0 108.649 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -64.95 -41.95 95.06 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-N 112.709 -2.041 . . . . 0.0 109.331 179.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 37.3 tp -53.29 -45.78 69.06 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-O 122.141 0.972 . . . . 0.0 109.357 179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.8 mttm -57.87 -50.92 71.67 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.3 m -51.57 -52.01 50.82 Favored 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.518 ' CG ' HD13 ' A' ' 10' ' ' ALC . 4.2 t60 -43.37 -55.51 4.06 Favored 'General case' 0 N--CA 1.5 2.058 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 91.9 mt -51.86 -58.49 2.25 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.935 0 O-C-N 124.185 0.928 . . . . 0.0 109.109 179.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 18.6 ttmm -40.87 -40.64 1.41 Allowed 'General case' 0 N--CA 1.496 1.854 0 O-C-N 125.103 1.502 . . . . 0.0 113.698 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 99.8 m -107.23 -8.18 16.51 Favored 'General case' 0 N--CA 1.508 2.468 0 N-CA-C 117.798 2.518 . . . . 0.0 117.798 -179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.45 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 13.5 mmmm -112.17 -27.38 8.38 Favored 'General case' 0 N--CA 1.514 2.741 0 CA-C-N 119.452 1.024 . . . . 0.0 113.407 -179.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.6 m-70 -101.8 -41.33 6.56 Favored 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 103.127 -2.916 . . . . 0.0 103.127 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 t -120.8 -170.03 1.93 Allowed 'General case' 0 N--CA 1.49 1.539 0 N-CA-C 103.417 -2.808 . . . . 0.0 103.417 179.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 ttmp? -121.76 -59.29 1.69 Allowed 'General case' 0 N--CA 1.494 1.771 0 N-CA-C 105.469 -2.048 . . . . 0.0 105.469 179.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 49.9 mt-10 -131.12 82.09 2.03 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 126.117 2.136 . . . . 0.0 109.031 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp . . . . . 0 N--CA 1.503 2.199 0 CA-C-O 122.417 1.103 . . . . 0.0 108.876 179.977 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.1 mtpt . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 119.639 -0.219 . . . . 0.0 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 35.7 p -124.12 159.45 29.98 Favored 'General case' 0 N--CA 1.498 1.975 0 CA-C-O 121.801 0.81 . . . . 0.0 111.899 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -128.82 151.46 49.57 Favored 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 112.96 -1.927 . . . . 0.0 107.488 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -116.58 149.85 38.99 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 124.302 1.001 . . . . 0.0 108.363 179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.2 t -57.59 171.66 0.43 Allowed 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.4 mm-40 -110.07 4.57 21.37 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.574 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -127.15 -47.1 1.49 Allowed 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.455 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 8.5 p -117.11 -161.08 0.79 Allowed 'General case' 0 N--CA 1.501 2.096 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.294 -179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.2 tp10 -116.82 57.12 0.79 Allowed 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.205 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.562 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 10.6 ptt180 -123.39 151.94 42.06 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 117.93 -1.508 . . . . 0.0 112.739 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 52.6 m -132.83 169.13 17.18 Favored 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 111.477 -2.601 . . . . 0.0 106.341 179.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -100.46 -21.79 15.24 Favored 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -114.04 179.42 3.96 Favored 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.165 -1.834 . . . . 0.0 107.264 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.4 m -105.2 -55.27 2.35 Favored 'General case' 0 N--CA 1.497 1.901 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 34.4 m -39.89 -52.51 2.39 Favored 'General case' 0 N--CA 1.51 2.526 0 CA-C-O 122.151 0.977 . . . . 0.0 109.432 179.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -47.81 -53.91 14.03 Favored 'General case' 0 N--CA 1.496 1.837 0 CA-C-N 113.447 -1.706 . . . . 0.0 111.181 179.475 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 24.1 tp -58.26 -44.66 88.47 Favored 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 114.779 -1.1 . . . . 0.0 110.476 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.3 mttm -55.72 -54.69 41.27 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 71.7 m -46.08 -56.89 4.98 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 107.139 -1.43 . . . . 0.0 107.139 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.407 ' CE1' HD23 ' A' ' 10' ' ' ALC . 26.5 t60 -44.35 -53.7 6.52 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 124.546 1.154 . . . . 0.0 110.312 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.42 -42.19 80.15 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.29 0 C-N-CA 119.169 -1.012 . . . . 0.0 109.966 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 tttp -87.71 17.28 4.84 Favored 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 120.523 -0.471 . . . . 0.0 111.515 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 51.6 m -121.54 -47.93 2.2 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.792 179.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.425 ' C ' ' H ' ' A' ' 27' ' ' SER . 94.7 mttt -100.61 -45.23 5.58 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -98.2 24.14 7.5 Favored 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 103.896 -2.631 . . . . 0.0 103.896 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.425 ' H ' ' C ' ' A' ' 25' ' ' LYS . 53.3 m 3.46 -113.58 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 -179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.401 ' O ' ' C ' ' A' ' 29' ' ' GLU . 14.7 ptpt -119.21 -18.8 8.57 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 118.174 -0.917 . . . . 0.0 110.913 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.401 ' C ' ' O ' ' A' ' 28' ' ' LYS . 0.3 OUTLIER -15.55 -58.03 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.772 0 O-C-N 126.442 2.339 . . . . 0.0 110.102 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 55.3 tttm . . . . . 0 N--CA 1.488 1.463 0 CA-C-N 112.568 -2.106 . . . . 0.0 106.857 179.555 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.5 tttt . . . . . 0 N--CA 1.49 1.554 0 CA-C-O 121.151 0.501 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.2 t -120.49 175.22 6.09 Favored 'General case' 0 N--CA 1.493 1.7 0 CA-C-N 114.01 -1.45 . . . . 0.0 113.327 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -107.63 98.09 7.74 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 102.096 -3.298 . . . . 0.0 102.096 179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 32.4 tp60 -95.84 118.65 32.9 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 124.782 1.301 . . . . 0.0 111.292 -179.641 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.0 t -44.0 162.0 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.866 0 CA-C-N 113.786 -1.552 . . . . 0.0 114.801 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -107.08 20.77 18.55 Favored 'General case' 0 N--CA 1.507 2.397 0 O-C-N 124.434 1.084 . . . . 0.0 111.064 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 43.5 m-85 -136.58 -53.79 0.72 Allowed 'General case' 0 N--CA 1.496 1.845 0 CA-C-N 115.216 -0.902 . . . . 0.0 111.126 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -113.1 -158.48 0.65 Allowed 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 114.304 -1.316 . . . . 0.0 109.751 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -114.92 57.74 0.72 Allowed 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.533 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.1 mtm180 -124.13 101.85 7.42 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 124.592 1.183 . . . . 0.0 112.0 -179.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.0 m -106.56 178.6 4.51 Favored 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 107.54 -1.282 . . . . 0.0 107.54 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.29 -0.19 11.03 Favored 'General case' 0 N--CA 1.501 2.11 0 O-C-N 123.859 0.724 . . . . 0.0 110.716 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -131.09 167.54 18.93 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 123.889 0.743 . . . . 0.0 110.614 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 89.8 p -93.19 -60.21 1.85 Allowed 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 109.457 -0.572 . . . . 0.0 109.457 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.8 m -34.98 -50.44 0.49 Allowed 'General case' 0 N--CA 1.502 2.139 0 CA-C-O 123.3 1.524 . . . . 0.0 108.279 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 17' ' ' ASN . 1.7 m120 -61.48 -54.71 39.85 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 111.872 -2.422 . . . . 0.0 112.14 179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.5 tp -52.84 -39.73 62.74 Favored 'General case' 0 N--CA 1.505 2.325 0 CA-C-N 118.205 0.457 . . . . 0.0 109.795 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.2 mttp -63.75 -56.4 15.91 Favored 'General case' 0 N--CA 1.5 2.051 0 N-CA-C 105.866 -1.902 . . . . 0.0 105.866 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.3 m -43.21 -47.67 6.42 Favored 'General case' 0 N--CA 1.508 2.443 0 CA-C-O 121.838 0.828 . . . . 0.0 109.606 179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' CG ' HD13 ' A' ' 10' ' ' ALC . 32.6 t60 -55.1 -61.21 2.47 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 113.769 -1.559 . . . . 0.0 108.872 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -48.46 -50.69 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.383 0 CA-C-N 117.875 0.307 . . . . 0.0 111.242 179.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -52.95 -24.98 10.51 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 114.744 1.387 . . . . 0.0 114.744 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.7 m -108.27 -39.65 5.4 Favored 'General case' 0 N--CA 1.504 2.254 0 N-CA-C 115.841 1.793 . . . . 0.0 115.841 -179.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -88.86 -20.9 24.03 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 116.237 1.94 . . . . 0.0 116.237 -179.243 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 63.0 m-70 -119.95 -52.09 2.22 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 114.187 1.181 . . . . 0.0 114.187 -179.63 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.4 t -12.11 86.54 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.389 0 N-CA-C 116.46 2.022 . . . . 0.0 116.46 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.0 mttm 58.65 -178.02 0.08 Allowed 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.0 tt0 -113.39 -38.38 4.4 Favored 'General case' 0 N--CA 1.496 1.829 0 CA-C-N 115.074 -0.966 . . . . 0.0 108.43 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.1 mptp? . . . . . 0 N--CA 1.502 2.133 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 179.702 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.431 ' HG3' ' N ' ' A' ' 2' ' ' THR . 20.6 pttp . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 111.474 0.176 . . . . 0.0 111.474 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.431 ' N ' ' HG3' ' A' ' 1' ' ' LYS . 24.2 m -113.24 168.35 9.8 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.212 0.945 . . . . 0.0 108.86 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.0 m-85 -123.84 117.21 24.36 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 114.066 -1.424 . . . . 0.0 110.695 -179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -122.88 153.29 39.84 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 105.847 -1.909 . . . . 0.0 105.847 179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 38.5 t -62.11 156.34 21.83 Favored 'General case' 0 N--CA 1.502 2.146 0 N-CA-C 118.129 2.64 . . . . 0.0 118.129 -179.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -111.58 25.43 11.67 Favored 'General case' 0 N--CA 1.504 2.247 0 CA-C-N 114.388 -1.278 . . . . 0.0 110.094 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.446 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.2 m-85 -133.28 -50.19 0.86 Allowed 'General case' 0 N--CA 1.497 1.905 0 CA-C-N 113.866 -1.515 . . . . 0.0 107.156 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.6 p -121.49 -161.78 0.93 Allowed 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 113.559 -1.655 . . . . 0.0 108.86 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 78.9 tt0 -115.77 57.53 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 114.173 -1.376 . . . . 0.0 109.456 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.534 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.434 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 39.6 mmt180 -126.08 133.45 51.67 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.405 ' O ' ' HB3' ' A' ' 13' ' ' ALA . 73.8 m -119.19 -53.99 2.23 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 124.252 0.97 . . . . 0.0 109.773 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.405 ' HB3' ' O ' ' A' ' 12' ' ' SER . . . 94.79 -31.57 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.559 0 O-C-N 125.959 2.037 . . . . 0.0 108.801 -179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -104.53 177.79 4.74 Favored 'General case' 0 N--CA 1.495 1.817 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.147 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 65.6 p -96.35 -55.66 2.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 123.507 0.505 . . . . 0.0 110.494 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.9 m -47.77 -56.11 8.13 Favored 'General case' 0 N--CA 1.5 2.028 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.7 -41.8 15.61 Favored 'General case' 0 N--CA 1.495 1.79 0 CA-C-N 113.239 -1.801 . . . . 0.0 112.918 179.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.2 tp -78.29 -46.52 19.99 Favored 'General case' 0 N--CA 1.498 1.946 0 C-N-CA 119.69 -0.804 . . . . 0.0 112.125 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -59.84 -47.24 86.53 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.219 179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.9 t -61.19 -46.45 90.44 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.178 -1.786 . . . . 0.0 106.178 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.447 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.7 t60 -46.83 -57.06 5.28 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -57.13 -62.51 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.852 0 C-N-CA 119.421 -0.912 . . . . 0.0 109.95 -179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 ttpp -39.69 -30.59 0.08 Allowed 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -104.57 -38.94 6.57 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 117.047 2.24 . . . . 0.0 117.047 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -91.81 -21.74 20.51 Favored 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 115.097 1.517 . . . . 0.0 115.097 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.6 m-70 -114.15 -42.39 3.36 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.4 p 33.11 -74.67 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 119.192 3.034 . . . . 0.0 119.192 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -120.91 93.28 3.98 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 113.824 1.046 . . . . 0.0 113.824 -179.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -120.09 74.86 1.06 Allowed 'General case' 0 N--CA 1.511 2.62 0 O-C-N 123.634 0.584 . . . . 0.0 111.062 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.497 1.886 0 O-C-N 119.135 -2.228 . . . . 0.0 110.164 0.194 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 68.5 p -128.33 175.16 8.7 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 124.603 1.19 . . . . 0.0 111.579 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.5 m-85 -112.55 162.27 15.83 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 104.456 -2.424 . . . . 0.0 104.456 179.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -120.67 152.79 37.76 Favored 'General case' 0 N--CA 1.508 2.434 0 CA-C-O 118.697 -0.668 . . . . 0.0 110.237 -179.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.482 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 44.0 t -72.87 175.4 6.59 Favored 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.364 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.482 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 8.4 mm100 -104.79 -14.46 15.52 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 115.082 -0.963 . . . . 0.0 113.147 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -112.2 -46.97 3.15 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 123.652 0.595 . . . . 0.0 110.692 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.577 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.1 p -112.93 -164.2 0.9 Allowed 'General case' 0 N--CA 1.498 1.956 0 O-C-N 124.396 1.06 . . . . 0.0 111.193 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -109.69 58.18 0.61 Allowed 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.681 -1.6 . . . . 0.0 110.076 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.577 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 14.4 mmt85 -121.15 129.56 53.31 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 114.841 -1.072 . . . . 0.0 111.009 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.6 m -127.16 167.39 16.09 Favored 'General case' 0 N--CA 1.5 2.059 0 CA-C-N 113.959 -1.473 . . . . 0.0 107.373 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.02 32.25 4.06 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 123.809 0.693 . . . . 0.0 110.982 179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -141.0 -69.81 0.38 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.3 m 137.91 -63.27 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.707 0 O-C-N 126.002 2.064 . . . . 0.0 110.201 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 51.7 p -55.74 -44.77 77.88 Favored 'General case' 0 N--CA 1.507 2.377 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.6 t-20 -48.08 -48.11 33.65 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 114.764 -1.107 . . . . 0.0 110.005 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.3 tp -61.81 -47.37 85.4 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.382 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -54.36 -51.18 65.56 Favored 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 119.239 -0.985 . . . . 0.0 108.447 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 57.8 m -49.23 -58.33 5.23 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 106.903 -1.517 . . . . 0.0 106.903 179.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' CE1' HD23 ' A' ' 10' ' ' ALC . 33.6 t60 -43.67 -56.0 4.02 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 124.916 1.385 . . . . 0.0 109.703 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -53.76 -54.6 18.45 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 C-N-CA 119.753 -0.779 . . . . 0.0 110.477 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 tpmt? -58.54 -7.91 1.08 Allowed 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 114.85 1.426 . . . . 0.0 114.85 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.0 p -118.7 -35.25 3.75 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 114.055 1.132 . . . . 0.0 114.055 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -99.64 -25.55 14.37 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 114.188 1.181 . . . . 0.0 114.188 -179.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.3 m-70 -111.33 5.25 19.65 Favored 'General case' 0 N--CA 1.5 2.054 0 CA-C-O 120.958 0.408 . . . . 0.0 110.599 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.1 t -127.12 153.38 46.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 105.065 -2.198 . . . . 0.0 105.065 179.672 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.73 38.34 3.81 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -112.5 -63.41 1.44 Allowed 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 106.692 -1.595 . . . . 0.0 106.692 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.6 tttm . . . . . 0 N--CA 1.495 1.794 0 CA-C-O 122.383 1.087 . . . . 0.0 109.041 179.845 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.0 mttm . . . . . 0 N--CA 1.492 1.64 0 N-CA-C 112.223 0.453 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 62.6 p -120.11 175.69 5.81 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-O 122.796 1.284 . . . . 0.0 114.237 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -119.97 172.24 7.87 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.253 -2.703 . . . . 0.0 107.019 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.3 mm100 -136.25 161.9 34.49 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 106.665 -1.605 . . . . 0.0 106.665 179.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 45.6 t -84.79 167.33 16.17 Favored 'General case' 0 N--CA 1.496 1.868 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.188 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -111.16 15.98 21.28 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-N 115.045 -0.98 . . . . 0.0 110.342 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.8 m-85 -133.79 -46.8 0.8 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 115.311 -0.859 . . . . 0.0 109.831 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.631 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.0 p -118.9 -159.51 0.76 Allowed 'General case' 0 N--CA 1.496 1.874 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.689 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -112.77 55.69 0.69 Allowed 'General case' 0 N--CA 1.493 1.68 0 CA-C-N 114.741 -1.118 . . . . 0.0 109.171 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.631 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.446 ' HD3' ' N ' ' A' ' 11' ' ' ARG . 0.0 OUTLIER -130.32 149.51 51.98 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.588 1.18 . . . . 0.0 110.295 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.6 m -136.27 -177.04 4.53 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 107.023 -1.473 . . . . 0.0 107.023 179.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.7 -24.42 6.7 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' CG ' ' H ' ' A' ' 15' ' ' SER . 25.8 t70 -124.21 -176.27 3.46 Favored 'General case' 0 N--CA 1.49 1.529 0 CA-C-N 113.879 -1.51 . . . . 0.0 110.573 -179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.445 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 29.0 m -95.43 -55.88 2.89 Favored 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.3 t -50.82 -40.29 55.31 Favored 'General case' 0 N--CA 1.505 2.31 0 CA-C-O 122.212 1.006 . . . . 0.0 108.78 179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -57.74 -49.17 77.46 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.706 -1.134 . . . . 0.0 109.981 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 21.4 tp -60.95 -47.61 85.63 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.203 -1.036 . . . . 0.0 108.203 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.7 ttpt -47.58 -55.63 8.86 Favored 'General case' 0 N--CA 1.504 2.253 0 N-CA-C 109.152 -0.685 . . . . 0.0 109.152 179.485 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 86.0 m -48.39 -59.85 3.14 Favored 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.417 ' CG ' HD13 ' A' ' 10' ' ' ALC . 34.3 t60 -44.91 -50.1 10.65 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 124.506 1.129 . . . . 0.0 110.185 179.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.1 mt -56.81 -55.41 20.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -70.22 8.18 0.83 Allowed 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 94.4 m -109.43 -47.06 3.44 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 123.649 0.593 . . . . 0.0 110.391 179.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -109.47 -15.72 14.15 Favored 'General case' 0 N--CA 1.506 2.336 0 N-CA-C 116.077 1.88 . . . . 0.0 116.077 -179.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.8 m-70 -111.74 -30.56 7.27 Favored 'General case' 0 N--CA 1.502 2.17 0 CA-C-N 117.765 0.257 . . . . 0.0 111.032 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.1 m 22.8 97.19 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 47.0 mmtm -100.27 154.41 18.49 Favored 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 114.286 -1.325 . . . . 0.0 109.353 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -132.14 -60.65 0.9 Allowed 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.773 -179.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.7 mttp . . . . . 0 N--CA 1.498 1.959 0 CA-C-N 114.566 -1.197 . . . . 0.0 109.319 -179.999 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 98.9 mttt . . . . . 0 N--CA 1.492 1.659 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 76.2 p -115.93 171.92 7.48 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.228 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 43.6 m-85 -120.19 154.51 34.71 Favored 'General case' 0 N--CA 1.5 2.05 0 CA-C-N 114.474 -1.239 . . . . 0.0 107.822 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -103.35 153.64 20.24 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 124.483 1.114 . . . . 0.0 109.309 -179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.451 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 47.4 t -62.94 -179.19 0.26 Allowed 'General case' 0 N--CA 1.501 2.081 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.522 179.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 1.1 tt0 -99.64 -24.16 14.82 Favored 'General case' 0 N--CA 1.496 1.867 0 CA-C-N 114.759 -1.11 . . . . 0.0 110.263 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.407 ' CZ ' ' NE2' ' A' ' 6' ' ' GLN . 54.9 m-85 -111.28 -42.08 4.0 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 123.739 0.649 . . . . 0.0 112.21 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -112.7 -164.32 0.91 Allowed 'General case' 0 N--CA 1.499 2.003 0 O-C-N 123.778 0.674 . . . . 0.0 110.135 -179.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -114.93 59.05 0.7 Allowed 'General case' 0 N--CA 1.486 1.343 0 CA-C-N 113.92 -1.491 . . . . 0.0 107.596 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.572 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.9 mmt180 -113.79 128.21 56.32 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 124.298 0.999 . . . . 0.0 113.15 -179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 40.4 m -127.15 172.51 10.48 Favored 'General case' 0 N--CA 1.498 1.942 0 CA-C-N 112.605 -2.089 . . . . 0.0 106.345 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.49 -21.36 12.94 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 123.814 0.696 . . . . 0.0 110.211 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -123.81 178.09 5.42 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 106.615 -1.624 . . . . 0.0 106.615 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 50.7 m -103.11 -31.74 10.01 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 109.565 -0.532 . . . . 0.0 109.565 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 79.9 p -59.63 -58.16 9.79 Favored 'General case' 0 N--CA 1.499 1.997 0 C-N-CA 120.543 -0.463 . . . . 0.0 109.942 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.53 HD22 ' N ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -57.93 -36.98 73.26 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.489 ' H ' HD22 ' A' ' 17' ' ' ASN . 42.9 tp -61.97 -39.41 92.06 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -61.17 -54.18 47.66 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 105.402 -2.073 . . . . 0.0 105.402 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 59.0 m -46.02 -53.03 10.82 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.402 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 28.6 t60 -46.38 -53.69 10.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 124.666 1.229 . . . . 0.0 109.613 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -57.8 -46.7 87.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 C-N-CA 119.668 -0.813 . . . . 0.0 111.554 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -68.12 -2.54 8.11 Favored 'General case' 0 N--CA 1.498 1.939 0 C-N-CA 119.65 -0.82 . . . . 0.0 112.245 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 95.6 m -114.1 -47.35 2.95 Favored 'General case' 0 N--CA 1.503 2.222 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.8 mttp -104.5 3.72 32.32 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 117.701 2.482 . . . . 0.0 117.701 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 73.2 m-70 -123.27 -57.27 1.69 Allowed 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 179.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 68.3 m -40.32 -48.9 2.73 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 115.689 1.737 . . . . 0.0 115.689 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp -116.36 -41.43 3.12 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.188 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.4 ' HG2' ' N ' ' A' ' 30' ' ' LYS . 36.8 tt0 -109.95 177.11 4.82 Favored 'General case' 0 N--CA 1.501 2.083 0 CA-C-N 113.918 -1.492 . . . . 0.0 109.642 -179.63 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.4 ' N ' ' HG2' ' A' ' 29' ' ' GLU . 24.0 pttm . . . . . 0 N--CA 1.502 2.128 0 CA-C-O 122.581 1.181 . . . . 0.0 109.854 179.561 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 69.1 m 104.17 168.1 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 O-C-N 126.271 2.232 . . . . 0.0 105.627 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -126.49 147.0 49.89 Favored 'General case' 0 N--CA 1.495 1.8 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.109 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -124.26 151.3 44.35 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.149 -1.796 . . . . 0.0 106.149 179.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 46.3 t -66.09 156.31 34.25 Favored 'General case' 0 N--CA 1.495 1.803 0 C-N-CA 118.667 -1.213 . . . . 0.0 111.218 -179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -109.26 29.46 7.51 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 124.602 1.188 . . . . 0.0 108.813 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.481 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 85.6 m-85 -138.35 -50.28 0.56 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-N 113.347 -1.752 . . . . 0.0 107.461 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.2 p -123.78 -158.08 0.79 Allowed 'General case' 0 N--CA 1.499 2.005 0 CA-C-N 114.1 -1.409 . . . . 0.0 109.098 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -115.92 55.32 0.8 Allowed 'General case' 0 N--CA 1.493 1.71 0 CA-C-N 114.816 -1.083 . . . . 0.0 109.756 -179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.477 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -122.79 143.47 49.81 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 65.4 m -143.33 154.8 44.14 Favored 'General case' 0 N--CA 1.496 1.85 0 CA-C-N 113.355 -1.748 . . . . 0.0 107.619 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.28 13.75 17.93 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 179.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -133.57 167.39 20.56 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 113.056 -1.884 . . . . 0.0 106.294 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 56.1 m -124.85 41.13 3.58 Favored 'General case' 0 N--CA 1.506 2.37 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -129.85 -52.85 1.14 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 101.494 -3.521 . . . . 0.0 101.494 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -52.64 -48.04 66.66 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.925 -1.943 . . . . 0.0 110.427 179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 tp -63.0 -36.14 82.58 Favored 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 120.142 -0.623 . . . . 0.0 111.194 -179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.3 tptt -64.42 -54.32 34.5 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 106.323 -1.732 . . . . 0.0 106.323 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 72.9 m -48.18 -55.08 11.3 Favored 'General case' 0 N--CA 1.498 1.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -43.1 -57.77 2.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 124.766 1.291 . . . . 0.0 110.459 179.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 87.6 mt -53.33 -54.3 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 C-N-CA 119.479 -0.888 . . . . 0.0 109.868 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.42 -15.66 0.7 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 t -120.18 -35.33 3.48 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 115.793 1.775 . . . . 0.0 115.793 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.6 mmtp -97.62 -15.61 20.38 Favored 'General case' 0 N--CA 1.504 2.236 0 N-CA-C 115.084 1.513 . . . . 0.0 115.084 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 65.8 m-70 -109.12 -50.28 3.02 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 15.3 p -17.26 -71.02 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.148 2.277 . . . . 0.0 117.148 179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 41.6 ttmt -124.59 -65.24 1.05 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 124.262 0.976 . . . . 0.0 113.401 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 21.67 91.53 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.392 0 O-C-N 125.406 1.691 . . . . 0.0 114.707 -179.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt . . . . . 0 N--CA 1.499 2.01 0 CA-C-O 122.571 1.177 . . . . 0.0 109.569 -179.918 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 91.5 mttt . . . . . 0 N--CA 1.495 1.789 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.3 p -120.24 -174.75 2.85 Favored 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 112.961 -1.927 . . . . 0.0 108.537 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -110.03 140.88 43.58 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 104.584 -2.376 . . . . 0.0 104.584 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 68.0 tp60 -106.83 152.6 23.65 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 124.756 1.285 . . . . 0.0 107.817 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 54.0 t -67.62 164.97 17.97 Favored 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 118.456 -1.298 . . . . 0.0 110.113 179.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -99.0 6.41 46.7 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-N 115.105 -0.952 . . . . 0.0 110.249 -179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -133.45 -42.58 0.85 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 123.751 0.657 . . . . 0.0 112.56 179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.0 p -117.76 -160.81 0.79 Allowed 'General case' 0 N--CA 1.499 2.025 0 O-C-N 124.09 0.869 . . . . 0.0 112.428 -179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -108.7 52.77 0.7 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 113.9 -1.5 . . . . 0.0 109.852 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.571 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -122.74 132.14 54.1 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 124.285 0.991 . . . . 0.0 112.805 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.7 m -131.59 154.48 48.82 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 106.129 -1.804 . . . . 0.0 106.129 179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -104.02 22.03 15.37 Favored 'General case' 0 N--CA 1.508 2.455 0 CA-C-N 119.364 0.983 . . . . 0.0 109.461 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -143.77 172.06 13.36 Favored 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 113.759 -1.564 . . . . 0.0 108.601 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 24.2 t -127.06 39.64 3.87 Favored 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.959 0.885 . . . . 0.0 113.272 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.4 t -131.91 -50.39 0.96 Allowed 'General case' 0 N--CA 1.497 1.896 0 N-CA-C 102.707 -3.071 . . . . 0.0 102.707 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.8 t-20 -61.12 -36.77 80.62 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 113.112 -1.858 . . . . 0.0 107.653 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.0 tp -63.09 -39.78 95.7 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.6 mmtm -59.47 -53.03 62.88 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 106.179 -1.785 . . . . 0.0 106.179 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.4 m -46.74 -59.41 3.06 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 107.469 -1.308 . . . . 0.0 107.469 179.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.494 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.5 t60 -41.01 -52.92 3.08 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 124.643 1.214 . . . . 0.0 109.525 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -57.53 -51.27 71.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 C-N-CA 118.83 -1.148 . . . . 0.0 109.69 179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -84.13 23.61 1.04 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 119.155 -1.018 . . . . 0.0 113.102 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 35.5 m -126.02 -46.53 1.67 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.244 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm -103.6 -40.73 6.2 Favored 'General case' 0 N--CA 1.499 2.003 0 C-N-CA 123.569 0.748 . . . . 0.0 113.018 -179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 84.9 m-70 -79.33 -50.97 10.04 Favored 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 118.553 -1.259 . . . . 0.0 108.312 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.9 t -4.18 90.88 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.45 0 O-C-N 125.784 1.928 . . . . 0.0 114.354 179.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 53.4 tptt -108.84 170.61 7.93 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.101 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -113.69 152.55 30.32 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.162 0.914 . . . . 0.0 110.098 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 40.3 ttpt . . . . . 0 N--CA 1.496 1.838 0 CA-C-N 114.544 -1.207 . . . . 0.0 108.93 -179.981 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.017 0.437 . . . . 0.0 110.183 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.4 p -128.69 171.87 11.78 Favored 'General case' 0 N--CA 1.497 1.924 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.439 179.785 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.1 m-85 -128.93 139.46 52.11 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 23.7 tp60 -113.6 134.95 54.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 124.647 1.217 . . . . 0.0 109.453 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 44.4 t -48.49 159.07 0.24 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 124.187 0.93 . . . . 0.0 113.144 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -114.52 35.98 3.99 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-O 122.315 1.055 . . . . 0.0 108.711 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 25.0 m-85 -144.58 -55.28 0.34 Allowed 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 112.783 -2.008 . . . . 0.0 109.392 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -117.86 -158.03 0.69 Allowed 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 114.086 -1.415 . . . . 0.0 110.275 -179.734 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -112.01 53.64 0.72 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 124.691 1.244 . . . . 0.0 109.584 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.533 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.579 ' HD3' ' H ' ' A' ' 11' ' ' ARG . 0.3 OUTLIER -129.98 133.15 46.6 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 123.645 0.591 . . . . 0.0 110.45 -179.998 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.3 m -131.6 -174.9 3.54 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.664 -1.607 . . . . 0.0 109.247 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.15 -37.33 8.61 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.062 -0.972 . . . . 0.0 113.019 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.618 ' H ' HD21 ' A' ' 17' ' ' ASN . 11.1 t70 -130.5 138.89 50.46 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-O 121.637 0.732 . . . . 0.0 112.83 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 63.2 p -42.64 -51.14 5.33 Favored 'General case' 0 N--CA 1.501 2.122 0 CA-C-N 115.272 -0.877 . . . . 0.0 112.939 179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 m -37.16 -50.05 0.93 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 113.852 1.056 . . . . 0.0 113.852 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.618 HD21 ' H ' ' A' ' 14' ' ' ASP . 18.2 p30 -79.51 -38.61 33.95 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 115.222 -0.899 . . . . 0.0 110.762 -179.691 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.3 tp -55.04 -41.69 71.71 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.4 tttm -60.08 -55.83 29.11 Favored 'General case' 0 N--CA 1.492 1.66 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 93.5 m -44.53 -51.65 8.69 Favored 'General case' 0 N--CA 1.503 2.223 0 O-C-N 124.242 0.964 . . . . 0.0 108.516 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.461 ' CG ' HD13 ' A' ' 10' ' ' ALC . 18.2 t60 -49.51 -60.42 2.87 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.586 179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 75.4 mt -49.5 -57.35 2.0 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.256 0 C-N-CA 120.552 -0.459 . . . . 0.0 110.905 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.4 tptp -35.89 -37.27 0.1 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 114.991 1.478 . . . . 0.0 114.991 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.2 t -111.89 -32.27 6.66 Favored 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 116.315 1.969 . . . . 0.0 116.315 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -84.35 -25.24 29.32 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 114.51 1.3 . . . . 0.0 114.51 -179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.0 m-70 -112.71 -38.85 4.46 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.7 t -106.14 -168.33 1.42 Allowed 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 105.173 -2.158 . . . . 0.0 105.173 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -119.44 163.72 16.82 Favored 'General case' 0 N--CA 1.503 2.185 0 CA-C-O 121.12 0.486 . . . . 0.0 112.093 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -128.94 -175.77 3.65 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 114.212 -1.358 . . . . 0.0 111.818 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.463 ' H ' ' HZ1' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-N 113.877 -1.51 . . . . 0.0 109.459 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 20.4 m -91.72 166.86 12.56 Favored 'General case' 0 N--CA 1.496 1.867 0 N-CA-C 106.776 -1.564 . . . . 0.0 106.776 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 16.7 m-85 -122.77 150.69 42.45 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 123.835 0.709 . . . . 0.0 109.374 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.423 HE21 ' C ' ' A' ' 9' ' ' GLU . 54.9 tp60 -120.98 166.12 14.3 Favored 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -80.71 166.72 20.76 Favored 'General case' 0 N--CA 1.506 2.334 0 C-N-CA 117.723 -1.591 . . . . 0.0 109.125 179.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -107.88 22.89 15.31 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 124.084 0.865 . . . . 0.0 110.75 -179.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -140.28 -49.58 0.46 Allowed 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 179.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.1 p -117.84 -162.49 0.88 Allowed 'General case' 0 N--CA 1.497 1.91 0 CA-C-N 114.247 -1.342 . . . . 0.0 109.231 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.423 ' C ' HE21 ' A' ' 4' ' ' GLN . 49.2 tp10 -113.97 59.0 0.67 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 114.223 -1.353 . . . . 0.0 108.402 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.507 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 5.3 tpt180 -122.31 137.72 54.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 123.959 0.787 . . . . 0.0 112.431 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 61.7 m -140.87 164.33 30.53 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-N 114.235 -1.348 . . . . 0.0 107.666 179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.39 4.91 11.79 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 123.388 0.43 . . . . 0.0 111.665 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 51.2 t0 -125.86 -59.67 1.33 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 123.713 0.633 . . . . 0.0 111.981 -179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 57.3 m 123.77 -36.31 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 O-C-N 126.46 2.35 . . . . 0.0 109.086 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 97.2 p -48.11 -52.75 19.11 Favored 'General case' 0 N--CA 1.51 2.574 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.6 t30 -58.01 -37.07 73.61 Favored 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 113.559 -1.655 . . . . 0.0 110.785 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.1 tp -64.13 -45.71 87.33 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 124.026 0.829 . . . . 0.0 110.513 -179.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -64.28 -52.96 56.03 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 107.63 -1.248 . . . . 0.0 107.63 179.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.7 m -51.22 -40.93 59.86 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 124.31 1.006 . . . . 0.0 108.692 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.447 ' CE1' HD23 ' A' ' 10' ' ' ALC . 9.9 t60 -58.52 -62.0 2.18 Favored 'General case' 0 N--CA 1.484 1.272 0 CA-C-N 113.75 -1.568 . . . . 0.0 107.63 179.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.4 mt -45.64 -60.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 C-N-CA 119.908 -0.717 . . . . 0.0 110.37 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -36.98 -35.57 0.1 Allowed 'General case' 0 N--CA 1.493 1.675 0 O-C-N 125.636 1.835 . . . . 0.0 114.882 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 15.1 m -109.51 -39.62 5.12 Favored 'General case' 0 N--CA 1.503 2.188 0 N-CA-C 118.062 2.616 . . . . 0.0 118.062 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -84.18 -23.25 30.64 Favored 'General case' 0 N--CA 1.501 2.116 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -179.391 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -109.57 -39.75 5.06 Favored 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 107.684 -1.228 . . . . 0.0 107.684 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 77.5 p 17.4 59.54 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.429 0 O-C-N 125.731 1.894 . . . . 0.0 114.441 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 22.6 ttpp -110.68 -35.64 5.94 Favored 'General case' 0 N--CA 1.495 1.824 0 CA-C-N 112.75 -2.023 . . . . 0.0 106.096 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.447 ' H ' ' CD ' ' A' ' 29' ' ' GLU . 0.9 OUTLIER -113.23 135.0 54.31 Favored 'General case' 0 N--CA 1.488 1.47 0 CA-C-N 113.277 -1.783 . . . . 0.0 106.969 179.734 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 70.8 mmtt . . . . . 0 N--CA 1.496 1.873 0 CA-C-N 114.538 -1.21 . . . . 0.0 109.962 -179.922 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 tttm . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.0 t -120.04 170.28 9.43 Favored 'General case' 0 N--CA 1.495 1.786 0 CA-C-O 122.624 1.202 . . . . 0.0 109.966 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -121.46 131.97 54.46 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 111.473 -2.603 . . . . 0.0 104.249 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -106.21 156.11 18.79 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 124.326 1.016 . . . . 0.0 110.684 -179.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.8 t -62.59 168.35 3.75 Favored 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 113.228 0.825 . . . . 0.0 113.228 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -105.01 2.13 29.29 Favored 'General case' 0 N--CA 1.503 2.204 0 CA-C-N 114.159 -1.382 . . . . 0.0 110.137 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 11.5 m-85 -122.81 -52.47 1.89 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.665 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.491 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -115.52 -158.23 0.67 Allowed 'General case' 0 N--CA 1.499 1.995 0 CA-C-N 114.352 -1.294 . . . . 0.0 109.955 -179.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -116.47 56.1 0.8 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 124.434 1.084 . . . . 0.0 108.386 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.491 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -114.78 131.17 56.89 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 124.402 1.063 . . . . 0.0 113.237 -179.587 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.0 m -124.75 173.01 8.85 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 112.714 -2.039 . . . . 0.0 108.315 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.38 -13.02 15.78 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 124.193 0.933 . . . . 0.0 109.822 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -126.79 178.89 5.66 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 114.487 -1.233 . . . . 0.0 107.981 179.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 70.6 m -108.46 -52.27 2.78 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 119.441 -0.314 . . . . 0.0 110.463 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.5 t -43.54 -46.62 7.1 Favored 'General case' 0 N--CA 1.507 2.414 0 CA-C-O 122.893 1.33 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 71.6 m-80 -63.11 -46.07 89.07 Favored 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.059 -1.428 . . . . 0.0 109.88 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.406 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 42.2 tp -55.87 -42.19 75.53 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 179.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.4 ttmm -57.73 -53.59 56.42 Favored 'General case' 0 N--CA 1.497 1.882 0 N-CA-C 106.788 -1.56 . . . . 0.0 106.788 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.1 m -46.74 -54.53 9.51 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 18' ' ' LEU . 15.1 t60 -45.66 -59.73 2.59 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.081 0.863 . . . . 0.0 109.176 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.5 mt -47.73 -53.97 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 N-CA-C 112.538 0.569 . . . . 0.0 112.538 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.5 tptp -51.22 -31.61 21.22 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 116.085 1.884 . . . . 0.0 116.085 -179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.5 t -104.99 -35.0 7.81 Favored 'General case' 0 N--CA 1.508 2.452 0 N-CA-C 115.609 1.707 . . . . 0.0 115.609 -179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 62.7 mmtt -83.78 -27.33 28.92 Favored 'General case' 0 N--CA 1.5 2.03 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 82.0 m-70 -111.08 -61.89 1.62 Allowed 'General case' 0 N--CA 1.487 1.414 0 O-C-N 123.942 0.776 . . . . 0.0 109.794 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 29.9 m 64.4 -72.43 0.06 Allowed 'General case' 0 N--CA 1.507 2.399 0 O-C-N 125.837 1.961 . . . . 0.0 110.021 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -115.5 -179.51 3.66 Favored 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 104.193 -2.521 . . . . 0.0 104.193 179.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -122.93 160.74 25.56 Favored 'General case' 0 N--CA 1.5 2.041 0 C-N-CA 119.795 -0.762 . . . . 0.0 109.896 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt . . . . . 0 N--CA 1.498 1.945 0 CA-C-N 114.623 -1.171 . . . . 0.0 108.906 179.936 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 85.5 tttt . . . . . 0 N--CA 1.488 1.45 0 N-CA-C 107.594 -1.261 . . . . 0.0 107.594 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 52.6 p -107.22 170.54 7.89 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.035 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.415 ' N ' ' CD1' ' A' ' 3' ' ' TYR . 3.9 m-85 -120.74 156.0 32.74 Favored 'General case' 0 N--CA 1.493 1.718 0 CA-C-N 112.954 -1.93 . . . . 0.0 105.863 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.433 HE22 ' HA ' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -121.01 137.68 54.53 Favored 'General case' 0 N--CA 1.502 2.128 0 O-C-N 124.205 0.941 . . . . 0.0 108.905 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 49.8 t -56.09 161.08 2.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.596 -0.842 . . . . 0.0 109.814 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -101.65 -6.48 23.73 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 114.634 -1.167 . . . . 0.0 111.646 -179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 18.5 m-30 -112.41 -45.2 3.28 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 124.326 1.016 . . . . 0.0 109.246 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.649 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.3 p -116.73 -163.43 0.91 Allowed 'General case' 0 N--CA 1.504 2.273 0 O-C-N 123.476 0.485 . . . . 0.0 110.139 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.433 ' HA ' HE22 ' A' ' 4' ' ' GLN . 32.7 tt0 -111.48 56.34 0.65 Allowed 'General case' 0 N--CA 1.491 1.588 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.169 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.649 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 21.3 ptt-85 -142.57 152.65 42.79 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 118.803 -1.159 . . . . 0.0 111.496 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -131.99 176.5 8.31 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 112.621 -2.081 . . . . 0.0 107.216 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -102.08 -20.87 14.58 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 124.276 0.985 . . . . 0.0 108.776 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -123.93 178.21 5.39 Favored 'General case' 0 N--CA 1.491 1.613 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.744 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -93.87 -49.93 5.59 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 t -51.58 -51.8 52.52 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 179.575 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -54.64 -22.87 14.87 Favored 'General case' 0 N--CA 1.502 2.165 0 CA-C-N 114.746 -1.116 . . . . 0.0 113.923 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 55.0 tp -87.64 -46.69 9.3 Favored 'General case' 0 N--CA 1.5 2.053 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.419 ' HD2' ' HA ' ' A' ' 19' ' ' LYS . 53.0 tptt -56.07 -49.34 74.07 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.1 p -51.03 -52.54 42.06 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.155 -1.054 . . . . 0.0 108.155 179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.439 ' HD1' ' HD2' ' A' ' 25' ' ' LYS . 7.3 t60 -44.73 -54.76 5.93 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 124.261 0.975 . . . . 0.0 108.47 179.407 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 90.0 mt -55.47 -55.94 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.202 0 CA-C-O 121.665 0.745 . . . . 0.0 110.585 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -52.66 -12.77 0.32 Allowed 'General case' 0 N--CA 1.493 1.721 0 CA-C-N 113.235 -1.802 . . . . 0.0 113.172 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 91.0 m -115.02 -44.6 3.01 Favored 'General case' 0 N--CA 1.5 2.027 0 N-CA-C 115.309 1.596 . . . . 0.0 115.309 -179.53 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.439 ' HD2' ' HD1' ' A' ' 21' ' ' HIS . 54.8 mttp -97.99 -11.75 22.71 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 117.972 2.582 . . . . 0.0 117.972 -179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 66.5 m-70 -112.83 -41.36 3.8 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 118.597 0.635 . . . . 0.0 112.626 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 71.7 p -106.13 144.97 32.08 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 125.156 1.535 . . . . 0.0 111.196 -179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.7 mtmm -114.44 177.92 4.47 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-N 111.113 -2.767 . . . . 0.0 105.666 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -109.66 53.09 0.7 Allowed 'General case' 0 N--CA 1.498 1.93 0 CA-C-O 122.022 0.915 . . . . 0.0 109.317 -179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt . . . . . 0 N--CA 1.505 2.315 0 CA-C-N 112.267 -2.242 . . . . 0.0 116.133 179.876 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 28.7 tptp . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.1 t -118.1 170.4 8.89 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 114.73 -1.123 . . . . 0.0 108.148 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 34.3 m-85 -131.31 155.13 47.72 Favored 'General case' 0 N--CA 1.497 1.896 0 CA-C-N 112.727 -2.033 . . . . 0.0 109.642 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -118.01 155.62 29.97 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 125.01 1.444 . . . . 0.0 109.296 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.457 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 53.3 t -63.46 174.55 1.25 Allowed 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 114.649 1.352 . . . . 0.0 114.649 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.457 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 71.2 mt-30 -97.47 -24.98 15.35 Favored 'General case' 0 N--CA 1.504 2.262 0 CA-C-N 114.3 -1.318 . . . . 0.0 112.864 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -107.94 -42.59 4.65 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 123.707 0.629 . . . . 0.0 109.893 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.9 p -114.31 -162.88 0.83 Allowed 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.9 tp10 -121.61 61.66 0.93 Allowed 'General case' 0 N--CA 1.491 1.619 0 CA-C-N 114.515 -1.22 . . . . 0.0 108.122 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.554 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 18.9 ttm-85 -101.55 129.06 47.56 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 124.243 0.965 . . . . 0.0 112.095 -179.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.8 m -133.73 165.31 25.25 Favored 'General case' 0 N--CA 1.498 1.955 0 CA-C-N 113.573 -1.649 . . . . 0.0 108.79 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.26 -10.99 14.6 Favored 'General case' 0 N--CA 1.503 2.19 0 CA-C-O 121.89 0.852 . . . . 0.0 108.989 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -121.56 172.1 8.34 Favored 'General case' 0 C--N 1.305 -1.334 0 CA-C-N 113.335 -1.757 . . . . 0.0 109.62 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 39.1 t -104.62 -63.1 1.25 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.099 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 p -35.39 -41.72 0.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 CA-C-O 122.02 0.914 . . . . 0.0 112.181 179.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -69.81 -55.21 10.43 Favored 'General case' 0 N--CA 1.494 1.754 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.918 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.6 tp -54.18 -38.34 65.47 Favored 'General case' 0 N--CA 1.507 2.388 0 CA-C-O 121.8 0.809 . . . . 0.0 110.561 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -62.94 -55.07 29.17 Favored 'General case' 0 N--CA 1.493 1.705 0 N-CA-C 107.154 -1.424 . . . . 0.0 107.154 179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 40.8 m -50.03 -50.85 46.1 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 179.234 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.516 ' HD1' ' HZ3' ' A' ' 25' ' ' LYS . 22.3 t60 -45.48 -60.38 2.2 Favored 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 179.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -50.54 -61.66 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 123.692 0.62 . . . . 0.0 110.696 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 36.0 ttmt -39.75 -38.67 0.67 Allowed 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.9 t -104.32 -31.51 9.52 Favored 'General case' 0 N--CA 1.503 2.215 0 N-CA-C 116.906 2.187 . . . . 0.0 116.906 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HZ3' ' HD1' ' A' ' 21' ' ' HIS . 46.7 mttp -90.32 -23.49 21.13 Favored 'General case' 0 N--CA 1.504 2.233 0 N-CA-C 113.998 1.111 . . . . 0.0 113.998 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -114.96 -48.55 2.83 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 123.628 0.58 . . . . 0.0 110.251 -179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.4 m 112.28 169.41 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 127.267 2.855 . . . . 0.0 104.086 -179.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -122.13 -58.02 1.74 Allowed 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 105.9 -1.889 . . . . 0.0 105.9 179.767 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.8 tp10 -126.36 -51.78 1.51 Allowed 'General case' 0 N--CA 1.492 1.656 0 CA-C-N 112.624 -2.08 . . . . 0.0 107.066 179.728 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 64.7 tttp . . . . . 0 N--CA 1.494 1.755 0 CA-C-N 113.63 -1.623 . . . . 0.0 108.648 -179.934 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 22.5 pttp . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 120.834 0.349 . . . . 0.0 110.38 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 25.9 m -108.16 167.44 10.01 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.653 -1.24 . . . . 0.0 107.653 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -130.78 148.46 52.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.417 ' NE2' ' H ' ' A' ' 5' ' ' CYS . 0.0 OUTLIER -121.7 158.66 28.25 Favored 'General case' 0 N--CA 1.504 2.245 0 O-C-N 124.0 0.813 . . . . 0.0 109.621 -179.844 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.417 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 51.9 t -73.53 168.43 19.29 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 120.165 -0.614 . . . . 0.0 112.302 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -111.99 20.31 17.05 Favored 'General case' 0 N--CA 1.505 2.293 0 O-C-N 124.717 1.261 . . . . 0.0 110.632 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.6 m-85 -137.04 -52.05 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.857 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.611 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.9 p -115.34 -161.45 0.78 Allowed 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 114.091 -1.413 . . . . 0.0 109.493 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 51.7 tp10 -112.85 59.49 0.64 Allowed 'General case' 0 N--CA 1.49 1.525 0 CA-C-N 114.338 -1.301 . . . . 0.0 108.359 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.611 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.75 141.79 51.42 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 124.236 0.96 . . . . 0.0 109.616 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.9 m -130.09 177.37 7.35 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-N 113.34 -1.754 . . . . 0.0 107.767 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -97.93 -38.3 9.46 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 114.259 -1.337 . . . . 0.0 107.46 179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -132.1 156.88 45.55 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 124.348 1.03 . . . . 0.0 108.98 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.1 t -59.9 -47.62 85.02 Favored 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.074 -0.966 . . . . 0.0 109.349 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.8 t -37.31 -48.13 0.88 Allowed 'General case' 0 N--CA 1.501 2.099 0 CA-C-O 122.133 0.968 . . . . 0.0 112.882 179.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -70.79 -48.47 54.1 Favored 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.953 -1.022 . . . . 0.0 109.74 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 17.9 tp -52.25 -43.22 64.22 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-O 121.714 0.769 . . . . 0.0 110.477 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -58.7 -57.9 10.95 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.4 m -45.4 -51.87 10.75 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.464 1.102 . . . . 0.0 108.048 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.7 t60 -50.91 -61.82 1.98 Allowed 'General case' 0 N--CA 1.487 1.397 0 CA-C-N 114.14 -1.391 . . . . 0.0 109.524 179.69 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.6 mt -47.64 -59.48 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.264 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -38.68 -42.91 0.84 Allowed 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 116.157 1.91 . . . . 0.0 116.157 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 48.8 m -106.45 -28.73 10.14 Favored 'General case' 0 N--CA 1.505 2.299 0 N-CA-C 116.121 1.897 . . . . 0.0 116.121 -179.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -85.15 -26.93 26.53 Favored 'General case' 0 N--CA 1.502 2.125 0 N-CA-C 113.498 0.925 . . . . 0.0 113.498 -179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -119.21 -42.41 2.68 Favored 'General case' 0 N--CA 1.499 2.015 0 N-CA-C 114.668 1.359 . . . . 0.0 114.668 -179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.0 m -106.43 -168.74 1.46 Allowed 'General case' 0 N--CA 1.491 1.605 0 CA-C-N 114.006 -1.452 . . . . 0.0 111.928 -179.511 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -106.03 103.07 12.47 Favored 'General case' 0 N--CA 1.492 1.637 0 CA-C-N 113.382 -1.735 . . . . 0.0 108.143 -179.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -47.84 152.92 0.68 Allowed 'General case' 0 N--CA 1.502 2.134 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.592 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm . . . . . 0 N--CA 1.498 1.958 0 CA-C-O 122.141 0.972 . . . . 0.0 109.125 -179.998 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm . . . . . 0 N--CA 1.494 1.749 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 47.5 p -111.67 -173.78 2.32 Favored 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 179.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -113.54 89.3 3.05 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-O 121.83 0.824 . . . . 0.0 109.721 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 18.6 mm100 -66.56 167.76 10.35 Favored 'General case' 0 N--CA 1.492 1.669 0 CA-C-N 113.887 -1.506 . . . . 0.0 107.656 179.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.502 ' HA ' HD21 ' A' ' 18' ' ' LEU . 48.9 t -85.86 152.64 22.83 Favored 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 117.498 -1.681 . . . . 0.0 111.021 -179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -101.77 27.85 6.12 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 113.742 -1.572 . . . . 0.0 109.276 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.7 m-85 -142.18 -48.7 0.36 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 114.36 -1.291 . . . . 0.0 108.706 179.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.5 p -119.66 -159.92 0.8 Allowed 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.658 1.224 . . . . 0.0 108.54 179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -115.64 56.15 0.77 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 124.417 1.073 . . . . 0.0 109.296 -179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.597 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.428 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 13.1 ttm180 -122.69 141.35 51.86 Favored 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 106.429 -1.693 . . . . 0.0 106.429 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.443 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 16.2 m -119.84 -58.28 1.9 Allowed 'General case' 0 N--CA 1.503 2.205 0 CA-C-O 118.322 -0.847 . . . . 0.0 112.795 179.876 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.72 -45.2 0.01 OUTLIER 'General case' 0 N--CA 1.515 2.823 0 O-C-N 125.646 1.841 . . . . 0.0 109.613 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -132.88 153.64 51.15 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.215 -1.031 . . . . 0.0 108.215 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 66.9 p -54.64 -53.67 51.75 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.457 0.646 . . . . 0.0 109.635 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.3 m -40.25 -44.75 1.95 Allowed 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 113.218 -1.81 . . . . 0.0 111.964 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.2 m-80 -80.96 -43.84 19.1 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.79 -1.095 . . . . 0.0 112.019 -179.8 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.502 HD21 ' HA ' ' A' ' 5' ' ' CYS . 1.4 tm? -55.46 -44.95 76.88 Favored 'General case' 0 N--CA 1.5 2.034 0 C-N-CA 119.369 -0.932 . . . . 0.0 108.943 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -56.19 -53.35 58.22 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 106.935 -1.506 . . . . 0.0 106.935 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.445 ' HA ' ' HZ3' ' A' ' 23' ' ' LYS . 40.4 m -46.11 -54.78 7.98 Favored 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.4 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.515 ' CG ' HD13 ' A' ' 10' ' ' ALC . 26.8 t60 -46.87 -55.23 8.35 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 124.463 1.102 . . . . 0.0 110.607 179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 78.3 mt -59.35 -38.28 73.93 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.851 0 O-C-N 123.55 0.531 . . . . 0.0 110.608 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.445 ' HZ3' ' HA ' ' A' ' 20' ' ' THR . 6.7 ttpm? -79.72 4.89 14.87 Favored 'General case' 0 N--CA 1.494 1.735 0 CA-C-N 115.638 -0.71 . . . . 0.0 111.929 179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.8 m -120.24 -43.45 2.52 Favored 'General case' 0 N--CA 1.508 2.428 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -102.02 -25.73 13.65 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 115.986 1.847 . . . . 0.0 115.986 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -100.9 -55.44 2.57 Favored 'General case' 0 N--CA 1.503 2.184 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.898 -179.619 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 33.4 p -131.26 161.35 32.47 Favored 'General case' 0 C--N 1.297 -1.699 0 N-CA-C 105.822 -1.918 . . . . 0.0 105.822 -179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -121.68 -71.33 0.74 Allowed 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.793 1.637 . . . . 0.0 108.256 -0.174 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -129.85 -50.99 1.14 Allowed 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 114.473 -1.24 . . . . 0.0 109.261 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.3 pttt . . . . . 0 N--CA 1.498 1.93 0 CA-C-O 122.549 1.166 . . . . 0.0 110.465 179.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.2 ttpp . . . . . 0 N--CA 1.489 1.498 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 72.1 p -117.21 155.12 29.95 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.625 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -125.39 148.09 48.92 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-N 112.847 -1.979 . . . . 0.0 106.457 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.42 HE21 ' HA ' ' A' ' 4' ' ' GLN . 0.8 OUTLIER -94.94 171.23 8.89 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 124.141 0.901 . . . . 0.0 109.577 -179.872 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.6 t -77.46 168.43 20.01 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 118.941 -1.104 . . . . 0.0 110.497 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -104.46 13.82 31.17 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 124.46 1.1 . . . . 0.0 113.305 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.458 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 30.1 m-85 -130.36 -48.2 1.08 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 106.311 -1.737 . . . . 0.0 106.311 179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.448 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.5 p -119.65 -160.21 0.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 113.384 -1.734 . . . . 0.0 108.582 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -118.31 57.34 0.85 Allowed 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 114.643 -1.162 . . . . 0.0 109.239 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.448 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -122.47 149.42 43.9 Favored 'General case' 0 N--CA 1.488 1.448 0 N-CA-C 115.495 1.665 . . . . 0.0 115.495 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 35.1 m -131.83 176.55 8.25 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-N 110.734 -2.939 . . . . 0.0 105.781 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -93.41 -32.25 14.31 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -117.81 -178.3 3.45 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 46.3 t -89.59 -47.37 8.01 Favored 'General case' 0 N--CA 1.497 1.902 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.05 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.5 m -32.63 -55.45 0.35 Allowed 'General case' 0 N--CA 1.508 2.453 0 CA-C-O 122.465 1.126 . . . . 0.0 113.082 179.809 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.83 -51.68 67.24 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 113.708 -1.587 . . . . 0.0 111.689 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 23.3 tp -55.08 -42.01 72.27 Favored 'General case' 0 N--CA 1.498 1.965 0 CA-C-O 121.148 0.499 . . . . 0.0 109.825 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -58.08 -57.96 10.53 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.356 -1.35 . . . . 0.0 107.356 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -45.8 -52.3 11.43 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 179.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 45.8 t60 -51.72 -59.07 4.71 Favored 'General case' 0 N--CA 1.491 1.6 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.512 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.9 mt -48.44 -53.98 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.47 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 22.4 tptp -46.61 -38.18 9.23 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-N 114.02 -1.445 . . . . 0.0 114.724 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.2 t -101.22 -31.73 10.87 Favored 'General case' 0 N--CA 1.505 2.315 0 N-CA-C 116.835 2.161 . . . . 0.0 116.835 -179.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 25' ' ' LYS . 3.9 mmmp? -93.28 -22.34 19.05 Favored 'General case' 0 N--CA 1.503 2.212 0 N-CA-C 115.918 1.821 . . . . 0.0 115.918 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.458 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 80.4 m-70 -117.18 -43.53 2.84 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 114.462 1.282 . . . . 0.0 114.462 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.1 t -114.5 -179.98 3.79 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 124.648 1.218 . . . . 0.0 111.344 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.429 ' NZ ' ' HB2' ' A' ' 28' ' ' LYS . 4.6 ttmp? -19.97 108.33 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.004 0 CA-C-N 112.572 -2.103 . . . . 0.0 114.82 179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.414 ' HA ' ' HA ' ' A' ' 28' ' ' LYS . 7.0 pt-20 -151.5 168.86 23.56 Favored 'General case' 0 N--CA 1.5 2.045 0 C-N-CA 125.364 1.465 . . . . 0.0 111.481 -0.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 18.7 pttp . . . . . 0 N--CA 1.507 2.396 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 179.949 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm . . . . . 0 N--CA 1.492 1.628 0 N-CA-C 109.93 -0.396 . . . . 0.0 109.93 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 67.2 p -103.75 166.71 10.25 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 114.987 1.477 . . . . 0.0 114.987 -179.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.407 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 13.4 m-85 -125.02 177.02 6.29 Favored 'General case' 0 N--CA 1.498 1.933 0 CA-C-N 111.976 -2.374 . . . . 0.0 109.325 -179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -128.19 158.09 39.05 Favored 'General case' 0 N--CA 1.504 2.257 0 N-CA-C 107.439 -1.319 . . . . 0.0 107.439 179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.465 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 43.4 t -78.92 173.02 12.97 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.825 179.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.465 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 0.7 OUTLIER -97.47 -27.75 14.3 Favored 'General case' 0 N--CA 1.498 1.96 0 CA-C-N 114.57 -1.195 . . . . 0.0 112.349 -179.773 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.401 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 64.7 m-85 -101.47 -42.68 6.17 Favored 'General case' 0 N--CA 1.5 2.045 0 O-C-N 123.55 0.531 . . . . 0.0 111.233 -179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.9 p -115.22 -160.91 0.76 Allowed 'General case' 0 N--CA 1.501 2.085 0 O-C-N 123.992 0.807 . . . . 0.0 110.808 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tp10 -113.05 55.94 0.69 Allowed 'General case' 0 N--CA 1.492 1.649 0 CA-C-N 114.346 -1.297 . . . . 0.0 109.741 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.546 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 62.2 mtt85 -131.35 152.89 50.19 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 119.997 -0.681 . . . . 0.0 111.843 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.5 m -130.46 173.77 10.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 105.399 -2.074 . . . . 0.0 105.399 179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.63 -8.56 12.08 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 112.95 0.722 . . . . 0.0 112.95 -179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -138.92 -55.4 0.6 Allowed 'General case' 0 N--CA 1.496 1.872 0 O-C-N 123.688 0.617 . . . . 0.0 111.303 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.41 ' O ' ' CB ' ' A' ' 16' ' ' SER . 56.8 m 123.24 170.88 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 O-C-N 127.436 2.96 . . . . 0.0 104.803 -179.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.41 ' CB ' ' O ' ' A' ' 15' ' ' SER . 59.0 m 103.25 -51.19 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.703 0 N-CA-C 101.573 -3.491 . . . . 0.0 101.573 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -69.22 -27.71 65.71 Favored 'General case' 0 N--CA 1.488 1.433 0 N-CA-C 105.327 -2.101 . . . . 0.0 105.327 179.512 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 18' ' ' LEU . 29.7 tp -73.95 -39.48 63.71 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 106.769 -1.567 . . . . 0.0 106.769 179.593 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.2 mtmt -62.46 -52.49 63.3 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.7 p -53.98 -51.1 64.99 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 107.223 -1.399 . . . . 0.0 107.223 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 51.2 t60 -44.92 -54.21 6.75 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 124.16 0.912 . . . . 0.0 108.902 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.2 mt -55.37 -44.54 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 C-N-CA 119.924 -0.71 . . . . 0.0 109.755 179.57 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -81.2 13.09 3.02 Favored 'General case' 0 N--CA 1.501 2.122 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.0 m -125.09 -41.91 2.05 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.102 0.477 . . . . 0.0 110.779 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 45.2 mmtm -102.22 -42.5 6.02 Favored 'General case' 0 N--CA 1.494 1.743 0 CA-C-N 114.7 -1.137 . . . . 0.0 112.779 -179.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.401 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 82.4 m-70 -97.95 24.1 7.34 Favored 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 119.222 -0.991 . . . . 0.0 112.952 -179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 96.2 p -130.99 -173.65 3.16 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 179.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -120.89 50.77 1.31 Allowed 'General case' 0 N--CA 1.494 1.738 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mm-40 -113.41 -141.89 0.38 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.245 -1.798 . . . . 0.0 107.499 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.2 pttm . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 121.514 0.673 . . . . 0.0 109.404 179.94 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 120.919 0.39 . . . . 0.0 110.802 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.407 ' HA ' ' HA ' ' A' ' 13' ' ' ALA . 6.5 t -121.44 172.09 8.31 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.27 1.033 . . . . 0.0 112.007 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -134.83 167.57 20.63 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 111.55 -2.568 . . . . 0.0 106.694 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.401 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 1.5 mm100 -111.54 170.44 8.13 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 124.712 1.258 . . . . 0.0 108.885 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 42.4 t -83.41 169.96 15.02 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 119.434 -0.906 . . . . 0.0 109.454 179.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 13.1 mp0 -106.4 14.1 27.73 Favored 'General case' 0 N--CA 1.505 2.275 0 O-C-N 123.693 0.621 . . . . 0.0 110.529 -179.864 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 34.6 m-85 -130.75 -51.2 1.06 Allowed 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 114.614 -1.176 . . . . 0.0 108.932 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.588 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.6 p -118.87 -160.07 0.79 Allowed 'General case' 0 N--CA 1.494 1.73 0 CA-C-N 113.591 -1.64 . . . . 0.0 110.32 -179.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -113.22 55.38 0.71 Allowed 'General case' 0 N--CA 1.493 1.72 0 CA-C-N 114.482 -1.235 . . . . 0.0 108.46 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.588 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 58.5 mtt180 -118.64 153.36 34.42 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 124.638 1.212 . . . . 0.0 108.162 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.423 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 69.8 m -131.67 -64.85 0.78 Allowed 'General case' 0 N--CA 1.505 2.286 0 N-CA-C 115.887 1.81 . . . . 0.0 115.887 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.423 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 128.3 -48.92 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.64 0 O-C-N 125.603 1.815 . . . . 0.0 107.371 -179.667 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -120.8 178.01 4.87 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 124.603 1.189 . . . . 0.0 109.151 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.8 t -107.36 51.48 0.74 Allowed 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 113.562 0.949 . . . . 0.0 113.562 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 32.6 p -127.09 -61.52 1.16 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 103.622 -2.733 . . . . 0.0 103.622 179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -58.83 -30.24 67.51 Favored 'General case' 0 N--CA 1.493 1.692 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.637 179.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 19.5 tp -73.67 -42.32 61.5 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.79 -179.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -64.96 -50.85 64.77 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 21.5 p -53.86 -49.94 67.36 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 106.285 -1.746 . . . . 0.0 106.285 179.452 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.47 ' CG ' HD13 ' A' ' 10' ' ' ALC . 35.8 t60 -46.81 -58.01 4.32 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 123.836 0.71 . . . . 0.0 109.565 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -49.57 -58.55 1.35 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 C-N-CA 120.022 -0.671 . . . . 0.0 111.693 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 33.6 mmtp -51.67 -35.18 41.39 Favored 'General case' 0 N--CA 1.5 2.036 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 59.2 p -90.37 -35.49 15.18 Favored 'General case' 0 N--CA 1.5 2.07 0 N-CA-C 116.559 2.059 . . . . 0.0 116.559 -179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.435 ' HZ2' ' HD1' ' A' ' 21' ' ' HIS . 41.2 mttp -104.42 -12.44 16.54 Favored 'General case' 0 N--CA 1.507 2.4 0 N-CA-C 116.501 2.038 . . . . 0.0 116.501 -179.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.406 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 64.9 m-70 -118.84 -39.58 2.95 Favored 'General case' 0 N--CA 1.507 2.387 0 CA-C-N 118.71 0.686 . . . . 0.0 109.744 179.79 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.8 t 26.89 60.02 0.08 Allowed 'General case' 0 N--CA 1.502 2.142 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.9 ttpm? -117.08 167.8 10.84 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.092 -1.448 . . . . 0.0 107.092 179.657 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' HA ' ' HA ' ' A' ' 30' ' ' LYS . 9.5 mp0 -109.86 113.37 26.06 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 118.352 -0.832 . . . . 0.0 110.474 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.455 ' HA ' ' HA ' ' A' ' 29' ' ' GLU . 18.6 ttmm . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 121.903 2.138 . . . . 0.0 108.545 0.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.7 mtpt . . . . . 0 N--CA 1.494 1.734 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 73.6 p -132.06 173.75 10.9 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 124.292 0.995 . . . . 0.0 111.951 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -116.95 152.31 34.84 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 179.529 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.8 mm100 -115.55 142.13 47.13 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 123.547 0.529 . . . . 0.0 110.528 179.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.481 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 49.9 t -60.87 174.24 0.65 Allowed 'General case' 0 N--CA 1.499 1.978 0 N-CA-C 114.163 1.171 . . . . 0.0 114.163 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.481 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 69.6 mt-30 -95.46 -29.16 14.55 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-N 114.191 -1.368 . . . . 0.0 112.7 -179.902 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 43.0 m-85 -108.01 -41.29 4.98 Favored 'General case' 0 N--CA 1.498 1.949 0 O-C-N 123.822 0.701 . . . . 0.0 111.902 -179.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.465 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 6.1 p -112.79 -163.84 0.88 Allowed 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.537 0.523 . . . . 0.0 109.731 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.2 tp10 -115.59 57.61 0.74 Allowed 'General case' 0 N--CA 1.495 1.806 0 CA-C-N 114.432 -1.258 . . . . 0.0 108.753 179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.504 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.426 HH11 ' HB3' ' A' ' 11' ' ' ARG . 8.4 ptp180 -117.24 112.81 21.3 Favored 'General case' 0 C--N 1.297 -1.679 0 CA-C-N 113.261 -1.79 . . . . 0.0 109.062 -179.713 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 42.5 m -113.0 163.9 14.12 Favored 'General case' 0 N--CA 1.498 1.937 0 CA-C-N 113.243 -1.799 . . . . 0.0 108.613 -179.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -110.18 -8.51 14.76 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 124.493 1.12 . . . . 0.0 108.337 179.768 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -128.4 149.73 50.42 Favored 'General case' 0 N--CA 1.489 1.514 0 CA-C-O 122.613 1.197 . . . . 0.0 111.592 179.864 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 20.6 p -124.26 140.35 53.04 Favored 'General case' 0 N--CA 1.49 1.575 0 N-CA-C 101.528 -3.508 . . . . 0.0 101.528 179.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 85.3 p -98.42 46.57 1.0 Allowed 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 122.253 2.297 . . . . 0.0 111.894 0.196 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -62.23 -37.71 86.43 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 103.703 -2.703 . . . . 0.0 103.703 179.448 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 33.0 tp -57.86 -45.34 86.43 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 113.147 -1.842 . . . . 0.0 110.378 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -62.89 -49.58 74.27 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.404 ' HA ' ' HZ2' ' A' ' 23' ' ' LYS . 49.1 m -50.3 -46.58 55.42 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 124.485 1.116 . . . . 0.0 108.173 179.498 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.504 ' CG ' HD13 ' A' ' 10' ' ' ALC . 5.7 t60 -53.18 -58.6 6.48 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 108.107 -1.072 . . . . 0.0 108.107 179.382 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.3 mt -49.57 -60.98 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.506 179.747 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.404 ' HZ2' ' HA ' ' A' ' 20' ' ' THR . 0.0 OUTLIER -42.38 -27.74 0.17 Allowed 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 114.573 1.323 . . . . 0.0 114.573 -179.93 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.8 m -103.28 -43.66 5.38 Favored 'General case' 0 N--CA 1.5 2.052 0 N-CA-C 117.126 2.269 . . . . 0.0 117.126 -179.403 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -89.39 -23.04 22.29 Favored 'General case' 0 N--CA 1.505 2.322 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -179.451 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 74.7 m-70 -109.83 -37.03 5.75 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 -179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 89.1 p 33.96 40.01 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.961 0 O-C-N 126.035 2.084 . . . . 0.0 113.438 -179.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.417 ' NZ ' ' HB2' ' A' ' 28' ' ' LYS . 3.9 ttmp? -126.22 48.64 2.09 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 102.527 -3.138 . . . . 0.0 102.527 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -132.71 71.85 1.48 Allowed 'General case' 0 N--CA 1.491 1.589 0 CA-C-N 112.259 -2.246 . . . . 0.0 105.306 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 57.2 mttp . . . . . 0 N--CA 1.499 1.988 0 CA-C-N 114.678 -1.146 . . . . 0.0 109.675 -179.734 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt . . . . . 0 N--CA 1.491 1.583 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 49.1 m 100.53 165.86 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 126.154 2.159 . . . . 0.0 105.381 -179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -121.86 88.43 2.93 Favored 'General case' 0 C--N 1.304 -1.413 0 CA-C-O 122.061 0.934 . . . . 0.0 108.781 179.987 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.418 HE22 ' HA ' ' A' ' 9' ' ' GLU . 0.1 OUTLIER -103.18 120.45 40.73 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 103.238 -2.875 . . . . 0.0 103.238 -179.95 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.4 t -36.92 157.64 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 116.425 2.009 . . . . 0.0 116.425 179.983 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 86.5 mm-40 -109.21 25.37 11.87 Favored 'General case' 0 N--CA 1.499 2.018 0 CA-C-N 114.379 -1.282 . . . . 0.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.457 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 97.2 m-85 -146.44 -55.35 0.26 Allowed 'General case' 0 N--CA 1.499 1.996 0 CA-C-N 114.826 -1.079 . . . . 0.0 110.132 179.97 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.4 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 7.9 p -111.57 -160.2 0.71 Allowed 'General case' 0 N--CA 1.502 2.14 0 CA-C-N 115.042 -0.981 . . . . 0.0 108.596 -179.91 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.418 ' HA ' HE22 ' A' ' 4' ' ' GLN . 20.2 tt0 -113.51 55.48 0.71 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.31 -179.974 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.501 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 16.3 ttm-85 -122.26 112.24 17.91 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 114.582 1.327 . . . . 0.0 114.582 -179.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 50.4 m -119.3 176.04 5.52 Favored 'General case' 0 N--CA 1.495 1.803 0 CA-C-N 113.675 -1.602 . . . . 0.0 107.086 179.712 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.54 6.3 9.52 Favored 'General case' 0 N--CA 1.499 2.016 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.282 179.902 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -124.1 164.93 18.41 Favored 'General case' 0 N--CA 1.498 1.948 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.22 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.0 t -96.24 -58.59 2.04 Favored 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.877 -179.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 73.4 p -49.92 -16.05 0.24 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 124.148 0.905 . . . . 0.0 113.176 179.838 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -94.99 -47.81 6.25 Favored 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 20.9 tp -60.41 -40.42 90.89 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.398 -0.921 . . . . 0.0 109.745 -179.717 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 20' ' ' THR . 6.0 ptpp? -63.15 -46.83 85.37 Favored 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 117.826 -1.55 . . . . 0.0 108.283 179.731 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.403 ' N ' ' HG3' ' A' ' 19' ' ' LYS . 22.6 m -53.62 -51.22 63.78 Favored 'General case' 0 N--CA 1.501 2.121 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 179.54 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.501 ' CG ' HD13 ' A' ' 10' ' ' ALC . 41.4 t60 -47.47 -58.87 3.69 Favored 'General case' 0 N--CA 1.493 1.701 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.586 179.412 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 95.4 mt -53.96 -56.73 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.02 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.447 179.941 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.7 tmtm? -45.56 -34.23 3.22 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-N 114.487 -1.233 . . . . 0.0 112.925 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.6 p -97.89 -36.99 9.99 Favored 'General case' 0 N--CA 1.505 2.306 0 N-CA-C 117.459 2.392 . . . . 0.0 117.459 -179.779 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -101.88 -11.69 18.83 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 116.543 2.053 . . . . 0.0 116.543 -179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.457 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 69.6 m-70 -123.12 -38.11 2.63 Favored 'General case' 0 N--CA 1.503 2.187 0 N-CA-C 116.046 1.869 . . . . 0.0 116.046 -179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.9 m -97.33 -64.76 1.01 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 124.352 1.033 . . . . 0.0 113.398 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 32.2 mmmt -119.19 153.69 34.53 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 124.313 1.008 . . . . 0.0 110.32 -179.997 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -101.56 -43.5 5.87 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 104.596 -2.372 . . . . 0.0 104.596 -0.042 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 179.772 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.7 mttp . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 103.397 -2.816 . . . . 0.0 103.397 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.0 m 61.68 162.95 0.08 Allowed 'General case' 0 N--CA 1.492 1.665 0 CA-C-N 112.299 -2.228 . . . . 0.0 112.272 179.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 41.4 m-85 -133.37 138.93 46.52 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 113.453 -1.703 . . . . 0.0 109.233 179.938 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.1 mm100 -122.3 147.26 46.45 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 179.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.427 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.3 t -62.28 171.73 1.75 Allowed 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 118.345 -1.342 . . . . 0.0 112.616 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.427 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 tp-100 -102.73 -20.44 14.36 Favored 'General case' 0 N--CA 1.501 2.077 0 CA-C-N 114.62 -1.173 . . . . 0.0 112.054 -179.674 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 71.6 m-85 -107.46 -45.23 4.11 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.948 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.0 p -113.35 -158.52 0.66 Allowed 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.86 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 tp10 -121.84 55.18 1.12 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-O 122.2 1.0 . . . . 0.0 110.237 -179.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.455 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -111.93 116.7 31.05 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 124.288 0.992 . . . . 0.0 110.817 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.9 m -128.18 172.11 11.3 Favored 'General case' 0 N--CA 1.494 1.741 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 179.805 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -132.1 -0.54 3.73 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.562 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -121.75 171.29 8.98 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 114.465 -1.243 . . . . 0.0 109.738 -179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.9 t -120.96 36.94 4.45 Favored 'General case' 0 N--CA 1.507 2.386 0 CA-C-O 122.242 1.02 . . . . 0.0 113.25 -179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 11.5 m -131.16 -52.32 1.03 Allowed 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 100.809 -3.774 . . . . 0.0 100.809 179.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 36.9 t30 -51.94 -44.23 63.84 Favored 'General case' 0 N--CA 1.491 1.578 0 CA-C-N 111.965 -2.38 . . . . 0.0 109.258 179.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 14.3 tp -65.77 -39.98 91.57 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.409 -0.917 . . . . 0.0 110.049 -179.935 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -65.08 -53.13 50.33 Favored 'General case' 0 N--CA 1.497 1.921 0 C-N-CA 118.429 -1.308 . . . . 0.0 109.288 179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 p -50.28 -41.96 51.54 Favored 'General case' 0 N--CA 1.502 2.159 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.61 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.455 ' CG ' HD13 ' A' ' 10' ' ' ALC . 33.4 t60 -59.3 -61.37 2.68 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.436 179.51 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.1 mt -48.71 -56.4 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.219 0 CA-C-O 120.985 0.421 . . . . 0.0 111.109 179.875 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 4.5 ttmp? -43.13 -34.37 1.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 114.431 -1.258 . . . . 0.0 114.33 179.884 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.4 m -101.94 -36.52 8.59 Favored 'General case' 0 N--CA 1.5 2.049 0 N-CA-C 117.464 2.394 . . . . 0.0 117.464 -179.392 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 6.6 mmpt? -97.68 -14.24 21.02 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.042 1.867 . . . . 0.0 116.042 -179.511 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.7 m-70 -124.62 -48.7 1.79 Allowed 'General case' 0 N--CA 1.502 2.157 0 N-CA-C 114.229 1.196 . . . . 0.0 114.229 -179.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 50.9 m -110.83 66.05 0.62 Allowed 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 113.926 -1.488 . . . . 0.0 111.087 -179.425 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.549 ' HD3' ' H ' ' A' ' 28' ' ' LYS . 0.0 OUTLIER -119.14 -48.7 2.42 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-N 113.311 -1.768 . . . . 0.0 107.368 179.943 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.517 ' N ' ' HG2' ' A' ' 28' ' ' LYS . 69.3 mm-40 -128.14 162.83 26.01 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.862 -1.517 . . . . 0.0 109.208 179.874 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? . . . . . 0 N--CA 1.497 1.901 0 CA-C-O 122.428 1.109 . . . . 0.0 109.335 179.822 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.4 ttpp . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 18.4 p -108.43 158.66 17.33 Favored 'General case' 0 N--CA 1.498 1.931 0 CA-C-O 122.11 0.957 . . . . 0.0 112.148 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 19.3 m-85 -126.66 149.19 49.66 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-N 112.423 -2.171 . . . . 0.0 108.262 179.996 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 mm100 -112.46 149.61 32.36 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 106.543 -1.651 . . . . 0.0 106.543 179.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 53.9 t -65.32 168.49 6.96 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 118.123 -1.431 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 18.9 mp0 -105.78 17.59 23.48 Favored 'General case' 0 N--CA 1.502 2.173 0 CA-C-N 114.858 -1.064 . . . . 0.0 111.319 -179.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.6 m-85 -139.55 -42.27 0.45 Allowed 'General case' 0 N--CA 1.496 1.858 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.334 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.518 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.7 p -121.63 -161.67 0.93 Allowed 'General case' 0 N--CA 1.497 1.879 0 CA-C-N 114.486 -1.233 . . . . 0.0 109.545 -179.829 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -117.1 59.55 0.76 Allowed 'General case' 0 N--CA 1.491 1.614 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.559 179.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.518 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 41.6 mtp-105 -114.93 129.38 56.7 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 -179.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.414 ' CB ' HD21 ' A' ' 17' ' ' ASN . 16.7 m -132.68 175.8 9.01 Favored 'General case' 0 N--CA 1.494 1.739 0 CA-C-N 113.061 -1.881 . . . . 0.0 107.728 179.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.84 -17.82 9.04 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 123.9 0.75 . . . . 0.0 110.425 179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -132.23 177.53 7.5 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 123.836 0.71 . . . . 0.0 109.477 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -114.68 51.04 0.92 Allowed 'General case' 0 N--CA 1.5 2.028 0 CA-C-O 122.067 0.937 . . . . 0.0 111.994 -179.818 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -131.86 -46.37 0.95 Allowed 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 104.934 -2.247 . . . . 0.0 104.934 179.529 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.414 HD21 ' CB ' ' A' ' 12' ' ' SER . 3.6 p-10 -75.54 -42.59 52.09 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 113.787 -1.551 . . . . 0.0 106.877 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 32.9 tp -60.49 -37.57 81.48 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.544 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 8.5 mmpt? -63.12 -53.63 50.47 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 179.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 99.6 m -49.02 -55.34 12.28 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.346 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.404 ' CG ' HD13 ' A' ' 10' ' ' ALC . 43.2 t60 -44.42 -56.1 4.51 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 114.559 -1.2 . . . . 0.0 109.662 179.537 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 92.2 mt -53.45 -52.7 30.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 C-N-CA 120.548 -0.461 . . . . 0.0 110.71 179.621 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.491 ' HA ' ' HB3' ' A' ' 27' ' ' SER . 60.6 pttt -75.54 10.83 1.5 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 118.115 -1.434 . . . . 0.0 114.116 -179.794 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 52.1 m -114.1 -44.99 3.09 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 123.728 0.642 . . . . 0.0 111.369 179.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.8 mtpt -107.86 -15.52 14.53 Favored 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 116.907 2.188 . . . . 0.0 116.907 -179.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 58.1 m-70 -110.27 -40.9 4.54 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-N 118.366 0.53 . . . . 0.0 112.017 -179.696 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.491 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 23.2 t -87.22 94.52 9.68 Favored 'General case' 0 N--CA 1.498 1.94 0 CA-C-N 114.982 -1.008 . . . . 0.0 109.812 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -110.47 -164.48 0.93 Allowed 'General case' 0 N--CA 1.498 1.969 0 CA-C-N 113.768 -1.56 . . . . 0.0 109.086 179.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.07 45.31 1.12 Allowed 'General case' 0 N--CA 1.503 2.209 0 CA-C-O 121.647 0.737 . . . . 0.0 112.304 -179.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.6 mttp . . . . . 0 N--CA 1.498 1.974 0 CA-C-O 122.418 1.104 . . . . 0.0 109.862 179.507 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 65.7 mttm . . . . . 0 N--CA 1.492 1.641 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.417 HG22 ' N ' ' A' ' 3' ' ' TYR . 77.1 m -131.91 167.64 19.27 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-O 121.746 0.784 . . . . 0.0 109.178 179.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.417 ' N ' HG22 ' A' ' 2' ' ' THR . 13.3 m-85 -124.87 96.32 4.83 Favored 'General case' 0 N--CA 1.49 1.552 0 N-CA-C 104.849 -2.278 . . . . 0.0 104.849 179.799 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.48 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 6.3 mm100 -87.35 158.45 19.03 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 124.664 1.227 . . . . 0.0 110.276 -179.686 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.416 ' HA ' HD11 ' A' ' 18' ' ' LEU . 48.7 t -76.91 161.11 28.66 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.448 -1.301 . . . . 0.0 112.936 -179.861 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 46.7 tp60 -104.64 18.72 21.71 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 124.879 1.362 . . . . 0.0 110.532 -179.692 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 95.3 m-85 -136.03 -48.08 0.66 Allowed 'General case' 0 N--CA 1.497 1.88 0 N-CA-C 107.44 -1.318 . . . . 0.0 107.44 -179.924 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.62 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 14.5 p -118.17 -163.43 0.95 Allowed 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 179.652 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -119.14 59.88 0.83 Allowed 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 122.282 1.039 . . . . 0.0 108.455 179.953 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.62 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 9.1 ptp180 -110.72 132.2 54.4 Favored 'General case' 0 N--CA 1.492 1.631 0 N-CA-C 104.829 -2.285 . . . . 0.0 104.829 179.612 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.433 ' O ' ' CB ' ' A' ' 13' ' ' ALA . 14.6 m -106.79 -54.48 2.46 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.751 -179.805 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.433 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 120.29 -36.14 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.437 0 O-C-N 126.471 2.357 . . . . 0.0 110.569 -179.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.533 ' H ' HD21 ' A' ' 17' ' ' ASN . 16.8 t70 -126.98 177.67 6.48 Favored 'General case' 0 N--CA 1.5 2.06 0 O-C-N 123.996 0.81 . . . . 0.0 110.228 -179.992 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 72.9 p -108.01 38.12 2.28 Favored 'General case' 0 N--CA 1.497 1.909 0 CA-C-O 121.997 0.904 . . . . 0.0 110.246 179.727 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 t -126.99 -61.22 1.18 Allowed 'General case' 0 N--CA 1.496 1.826 0 N-CA-C 102.98 -2.971 . . . . 0.0 102.98 179.588 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.533 HD21 ' H ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -61.58 -30.47 70.69 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 113.524 -1.671 . . . . 0.0 110.525 179.794 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.503 ' H ' HD22 ' A' ' 17' ' ' ASN . 63.0 tp -67.82 -41.65 82.74 Favored 'General case' 0 N--CA 1.498 1.927 0 C-N-CA 118.442 -1.303 . . . . 0.0 110.225 179.842 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -63.89 -49.26 73.39 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 179.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 90.5 m -47.42 -56.37 7.09 Favored 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 32.5 t60 -43.64 -63.02 0.92 Allowed 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.079 179.363 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 84.1 mt -45.34 -58.85 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.201 0 O-C-N 123.818 0.698 . . . . 0.0 112.359 -179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 60.1 mttp -39.62 -44.28 1.46 Allowed 'General case' 0 N--CA 1.506 2.345 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -179.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.2 p -98.12 -34.73 10.65 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 118.502 2.779 . . . . 0.0 118.502 -179.28 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -85.85 -25.07 26.45 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 114.93 1.456 . . . . 0.0 114.93 -179.438 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -112.6 -44.52 3.33 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 123.617 0.573 . . . . 0.0 109.954 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 26.6 m 45.91 24.75 0.25 Allowed 'General case' 0 N--CA 1.502 2.127 0 CA-C-N 113.914 -1.494 . . . . 0.0 114.292 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -124.51 47.78 2.05 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 179.691 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -10.13 -60.63 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.177 0 CA-C-N 112.379 -2.192 . . . . 0.0 115.755 179.912 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 124.65 1.219 . . . . 0.0 111.369 -179.84 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 84.1 tttt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.5 t -122.77 176.51 5.93 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 107.601 -1.259 . . . . 0.0 107.601 179.564 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 -140.46 165.63 26.92 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 111.908 -2.405 . . . . 0.0 110.509 -179.762 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -133.77 152.19 51.8 Favored 'General case' 0 N--CA 1.497 1.884 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.337 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.5 t -74.72 162.58 28.57 Favored 'General case' 0 N--CA 1.493 1.722 0 C-N-CA 118.362 -1.335 . . . . 0.0 109.951 179.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.3 tm0? -101.96 -0.69 33.37 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.363 -179.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -112.92 -52.27 2.79 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.844 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.644 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 15.4 p -117.76 -159.46 0.74 Allowed 'General case' 0 N--CA 1.498 1.929 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.333 -179.884 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -114.98 55.62 0.75 Allowed 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 114.797 -1.092 . . . . 0.0 108.354 179.953 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.644 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -124.16 157.47 34.61 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.262 -0.975 . . . . 0.0 111.884 -179.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.6 m -146.09 173.44 12.18 Favored 'General case' 0 N--CA 1.503 2.181 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.052 -179.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -142.65 28.39 1.62 Allowed 'General case' 0 N--CA 1.5 2.072 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 179.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -129.66 -62.42 0.97 Allowed 'General case' 0 N--CA 1.497 1.883 0 CA-C-N 115.199 -0.909 . . . . 0.0 112.18 -179.835 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 51.2 m 124.72 -60.5 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.636 0 C-N-CA 127.47 2.308 . . . . 0.0 109.017 -179.963 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.0 m -49.09 -55.49 12.01 Favored 'General case' 0 N--CA 1.508 2.447 0 N-CA-C 106.221 -1.77 . . . . 0.0 106.221 179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -43.3 -50.88 6.53 Favored 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 112.796 -2.002 . . . . 0.0 112.501 179.421 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 27.6 tp -61.83 -44.53 96.65 Favored 'General case' 0 N--CA 1.5 2.038 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.629 -179.615 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -59.33 -50.71 72.94 Favored 'General case' 0 N--CA 1.497 1.897 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 179.654 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 89.1 m -48.32 -54.3 14.3 Favored 'General case' 0 N--CA 1.501 2.089 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 179.501 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 33.9 t60 -47.52 -62.32 1.5 Allowed 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 114.696 -1.138 . . . . 0.0 108.509 179.526 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.9 mt -47.27 -62.54 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.106 0 C-N-CA 119.802 -0.759 . . . . 0.0 110.868 -179.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -39.26 -45.56 1.41 Allowed 'General case' 0 N--CA 1.495 1.802 0 O-C-N 125.235 1.584 . . . . 0.0 115.168 -179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 26.3 p -119.55 18.14 12.81 Favored 'General case' 0 N--CA 1.502 2.143 0 N-CA-C 117.977 2.584 . . . . 0.0 117.977 -179.858 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -125.5 -27.04 3.48 Favored 'General case' 0 N--CA 1.509 2.517 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 179.804 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 62.7 m-70 -107.42 -43.6 4.51 Favored 'General case' 0 N--CA 1.498 1.973 0 N-CA-C 106.23 -1.767 . . . . 0.0 106.23 179.808 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 86.2 p -124.25 172.88 8.73 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 102.602 -3.11 . . . . 0.0 102.602 179.568 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 18.5 ttmm -134.63 71.82 1.45 Allowed 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 104.713 -2.329 . . . . 0.0 104.713 -0.153 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.1 mm-40 -96.35 160.08 14.61 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 114.318 -1.31 . . . . 0.0 111.047 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 66.5 mttm . . . . . 0 N--CA 1.496 1.847 0 CA-C-N 113.525 -1.671 . . . . 0.0 110.255 -179.772 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.107 0.479 . . . . 0.0 110.642 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 40.0 p -134.45 178.01 7.32 Favored 'General case' 0 N--CA 1.501 2.082 0 CA-C-N 114.613 -1.176 . . . . 0.0 109.928 179.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -120.91 162.03 20.56 Favored 'General case' 0 N--CA 1.5 2.074 0 CA-C-N 114.625 -1.17 . . . . 0.0 107.938 179.827 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.412 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 48.1 tp60 -127.04 165.81 18.77 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 124.374 1.046 . . . . 0.0 108.44 -179.922 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 7' ' ' TYR . 41.9 t -88.46 161.48 17.0 Favored 'General case' 0 N--CA 1.503 2.176 0 C-N-CA 118.777 -1.169 . . . . 0.0 109.743 179.68 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 33.6 tt0 -111.64 25.64 11.44 Favored 'General case' 0 N--CA 1.504 2.229 0 CA-C-O 122.146 0.974 . . . . 0.0 109.401 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.44 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 60.3 m-85 -132.93 -49.39 0.88 Allowed 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 106.592 -1.633 . . . . 0.0 106.592 179.716 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 17.9 p -123.26 -160.05 0.88 Allowed 'General case' 0 N--CA 1.499 2.019 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.482 179.928 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -115.21 57.46 0.73 Allowed 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.943 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.622 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 42.5 ttm180 -117.76 143.1 46.54 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 124.827 1.33 . . . . 0.0 109.67 -179.901 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 73.3 m -136.05 168.6 19.07 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 113.991 -1.458 . . . . 0.0 107.073 179.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -119.91 7.6 10.96 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 123.616 0.572 . . . . 0.0 111.668 -179.972 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -134.6 -63.9 0.69 Allowed 'General case' 0 N--CA 1.501 2.11 0 N-CA-C 115.594 1.701 . . . . 0.0 115.594 -179.835 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 40.6 t 134.98 -49.82 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 C-N-CA 126.197 1.799 . . . . 0.0 106.46 -179.52 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 m -51.38 -45.06 62.33 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 107.344 -1.354 . . . . 0.0 107.344 179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -61.81 -39.92 93.42 Favored 'General case' 0 N--CA 1.489 1.498 0 CA-C-N 113.137 -1.847 . . . . 0.0 109.834 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 19.1 tp -60.58 -43.61 97.14 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-O 120.898 0.38 . . . . 0.0 110.74 -179.815 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 21.2 mttm -62.4 -50.82 70.02 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 107.753 -1.203 . . . . 0.0 107.753 179.64 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 95.3 m -50.28 -51.5 44.45 Favored 'General case' 0 N--CA 1.499 1.979 0 N-CA-C 106.911 -1.514 . . . . 0.0 106.911 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.451 ' CG ' HD13 ' A' ' 10' ' ' ALC . 12.9 t60 -46.58 -64.45 0.76 Allowed 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.19 -1.411 . . . . 0.0 107.19 179.367 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 88.4 mt -42.01 -59.75 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.054 0 O-C-N 124.327 1.017 . . . . 0.0 111.168 -179.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 23.4 ttpp -42.99 -50.82 5.83 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 124.269 0.981 . . . . 0.0 113.192 179.883 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 25.0 m -112.08 35.8 3.6 Favored 'General case' 0 N--CA 1.508 2.446 0 N-CA-C 113.869 1.062 . . . . 0.0 113.869 -179.773 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.443 ' HG3' ' HD1' ' A' ' 21' ' ' HIS . 36.5 mmtm -145.15 -32.01 0.4 Allowed 'General case' 0 N--CA 1.509 2.492 0 O-C-N 122.019 -0.426 . . . . 0.0 110.226 179.807 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 76.0 m-70 -111.87 -38.48 4.82 Favored 'General case' 0 N--CA 1.5 2.036 0 CA-C-N 115.205 -0.907 . . . . 0.0 109.803 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.431 ' O ' ' CB ' ' A' ' 28' ' ' LYS . 61.1 p -113.85 56.04 0.71 Allowed 'General case' 0 N--CA 1.497 1.885 0 O-C-N 124.781 1.301 . . . . 0.0 112.274 -179.901 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.431 ' CB ' ' O ' ' A' ' 27' ' ' SER . 62.4 tttp 112.14 158.19 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.809 0 C-N-CA 127.112 2.165 . . . . 0.0 108.623 179.802 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -128.33 -66.17 0.86 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.6 ' HD3' ' H ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.265 0 N-CA-C 116.122 1.897 . . . . 0.0 116.122 179.822 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt . . . . . 0 N--CA 1.491 1.604 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 58.9 m -136.0 171.16 14.87 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 123.705 0.628 . . . . 0.0 109.525 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -119.23 139.79 51.3 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-N 114.278 -1.328 . . . . 0.0 107.572 179.714 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.456 ' NE2' ' HA ' ' A' ' 9' ' ' GLU . 36.1 tp60 -122.84 136.84 55.0 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 124.082 0.864 . . . . 0.0 108.715 179.863 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.424 ' N ' ' NE2' ' A' ' 4' ' ' GLN . 43.8 t -56.86 169.12 0.53 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 124.026 0.829 . . . . 0.0 112.613 179.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.401 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 4.3 mm100 -111.79 7.81 20.35 Favored 'General case' 0 N--CA 1.5 2.038 0 CA-C-N 114.74 -1.118 . . . . 0.0 112.81 -179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.5 m-85 -131.17 -49.52 1.01 Allowed 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.756 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.443 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 10.5 p -109.88 -160.76 0.73 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.965 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.456 ' HA ' ' NE2' ' A' ' 4' ' ' GLN . 3.4 tp10 -116.93 54.07 0.88 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 124.313 1.008 . . . . 0.0 110.837 -179.739 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.507 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.47 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 7.8 mmt85 -120.82 124.51 45.23 Favored 'General case' 0 N--CA 1.495 1.801 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.839 -179.647 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.1 m -130.91 172.78 11.66 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 106.61 -1.626 . . . . 0.0 106.61 179.283 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -118.63 -17.01 9.37 Favored 'General case' 0 N--CA 1.498 1.974 0 CA-C-N 116.054 -0.521 . . . . 0.0 109.701 179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -130.12 161.34 31.28 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 124.166 0.916 . . . . 0.0 112.437 -179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 31.8 t -70.43 -65.16 0.77 Allowed 'General case' 0 N--CA 1.496 1.832 0 CA-C-N 114.386 -1.279 . . . . 0.0 108.982 -179.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.5 m -45.6 -26.37 0.59 Allowed 'General case' 0 N--CA 1.5 2.044 0 O-C-N 124.334 1.021 . . . . 0.0 110.105 179.562 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.8 t30 -77.38 -57.3 3.91 Favored 'General case' 0 N--CA 1.499 1.983 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 18.8 tp -53.07 -38.99 62.97 Favored 'General case' 0 N--CA 1.5 2.048 0 N-CA-C 108.898 -0.779 . . . . 0.0 108.898 179.999 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 tptt -61.01 -58.15 9.61 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 179.543 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.2 m -45.76 -43.52 13.12 Favored 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 179.272 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.507 ' CG ' HD13 ' A' ' 10' ' ' ALC . 29.6 t60 -58.49 -61.07 2.86 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 124.445 1.091 . . . . 0.0 108.897 179.453 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 97.2 mt -48.57 -52.16 9.44 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.435 0 CA-C-O 120.933 0.397 . . . . 0.0 110.666 179.941 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.6 mtpp -48.54 -31.65 6.82 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.319 1.6 . . . . 0.0 115.319 179.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.466 ' HB ' ' HZ2' ' A' ' 25' ' ' LYS . 6.1 m -106.36 -33.63 7.7 Favored 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.197 1.555 . . . . 0.0 115.197 -179.405 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.466 ' HZ2' ' HB ' ' A' ' 24' ' ' THR . 0.0 OUTLIER -93.86 -18.21 22.23 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -179.621 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -122.9 -48.94 1.99 Allowed 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -179.77 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -126.32 80.07 1.9 Allowed 'General case' 0 N--CA 1.499 2.023 0 N-CA-C 115.685 1.735 . . . . 0.0 115.685 -179.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -28.36 88.16 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.54 0 O-C-N 124.832 1.332 . . . . 0.0 113.725 179.507 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 5.35 146.5 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 121.064 3.728 . . . . 0.0 121.064 -179.78 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.502 2.163 0 O-C-N 119.452 -2.03 . . . . 0.0 110.478 0.181 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 3' ' ' TYR . 18.2 m -123.7 177.69 5.58 Favored 'General case' 0 N--CA 1.498 1.939 0 CA-C-N 114.517 -1.219 . . . . 0.0 108.815 -179.815 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.463 ' H ' HG22 ' A' ' 2' ' ' THR . 96.3 m-85 -118.56 131.23 56.22 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 123.764 0.665 . . . . 0.0 110.444 -179.938 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.407 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -114.6 -174.91 2.57 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 124.351 1.032 . . . . 0.0 108.923 179.689 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 46.0 t -81.18 163.31 23.16 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 116.192 1.923 . . . . 0.0 116.192 -179.515 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -100.21 -0.25 39.05 Favored 'General case' 0 N--CA 1.495 1.814 0 CA-C-N 112.353 -2.203 . . . . 0.0 111.34 -179.518 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 18.7 m-85 -119.46 -51.1 2.3 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 179.931 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.495 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.7 p -118.21 -162.02 0.86 Allowed 'General case' 0 N--CA 1.495 1.816 0 CA-C-N 114.175 -1.375 . . . . 0.0 108.135 -179.896 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -120.79 62.1 0.88 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.382 -1.281 . . . . 0.0 108.661 179.662 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.495 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.461 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 0.8 OUTLIER -123.48 130.71 53.09 Favored 'General case' 0 N--CA 1.498 1.968 0 N-CA-C 106.539 -1.652 . . . . 0.0 106.539 179.876 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.439 ' N ' ' HD2' ' A' ' 11' ' ' ARG . 71.9 m -120.0 -60.74 1.67 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 124.144 0.902 . . . . 0.0 109.058 179.7 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 12' ' ' SER . . . 107.86 -14.59 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.583 0 O-C-N 126.332 2.27 . . . . 0.0 109.353 -179.814 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -123.91 -179.19 4.3 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.995 179.883 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 79.9 p -105.74 -56.45 2.18 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 123.577 0.548 . . . . 0.0 110.761 -179.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -51.59 -45.43 63.15 Favored 'General case' 0 N--CA 1.497 1.885 0 CA-C-O 123.28 1.514 . . . . 0.0 109.605 -179.989 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -61.19 -42.95 99.49 Favored 'General case' 0 N--CA 1.494 1.738 0 CA-C-N 113.23 -1.805 . . . . 0.0 109.235 179.948 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 25.5 tp -61.84 -46.88 87.55 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 49.3 mtmt -55.38 -50.82 68.73 Favored 'General case' 0 N--CA 1.498 1.939 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 179.379 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 88.3 m -46.59 -54.14 10.04 Favored 'General case' 0 N--CA 1.508 2.437 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 179.206 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -50.28 -59.85 3.56 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-N 115.714 -0.676 . . . . 0.0 109.57 179.412 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.7 mt -44.72 -49.27 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.336 0 CA-C-O 121.134 0.493 . . . . 0.0 111.383 179.911 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmtm -56.75 -48.36 77.98 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 179.683 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 40.9 m -87.03 -18.14 31.3 Favored 'General case' 0 N--CA 1.502 2.148 0 N-CA-C 116.692 2.108 . . . . 0.0 116.692 -179.451 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -113.81 -24.82 8.93 Favored 'General case' 0 N--CA 1.501 2.08 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.714 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.439 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 73.8 m-70 -108.14 -55.68 2.34 Favored 'General case' 0 N--CA 1.501 2.113 0 N-CA-C 115.993 1.849 . . . . 0.0 115.993 -179.697 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 49.0 m -14.5 70.15 0.0 OUTLIER 'General case' 0 N--CA 1.517 2.918 0 O-C-N 125.906 2.004 . . . . 0.0 116.091 -179.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' N ' ' O ' ' A' ' 26' ' ' HIS . 14.0 mptt 48.57 54.08 11.13 Favored 'General case' 0 N--CA 1.504 2.275 0 CA-C-O 122.936 1.351 . . . . 0.0 109.671 -179.468 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -114.95 -66.66 1.06 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 112.475 -2.148 . . . . 0.0 108.51 -179.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.505 2.306 0 N-CA-C 116.809 2.152 . . . . 0.0 116.809 -179.993 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 61.9 tttm . . . . . 0 N--CA 1.488 1.451 0 N-CA-C 107.522 -1.288 . . . . 0.0 107.522 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 61.7 m -98.62 172.67 7.34 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 179.814 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 3' ' ' TYR . 34.2 m-85 -121.06 133.57 55.24 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 -179.767 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.413 HE21 ' C ' ' A' ' 4' ' ' GLN 0.262 0.0 OUTLIER -106.99 145.7 31.97 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 -179.388 . . . . . . . . 4 4 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.41 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 52.1 t -46.53 164.15 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 114.535 1.309 . . . . 0.0 114.535 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.41 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 72.6 mt-30 -111.77 16.58 20.42 Favored 'General case' 0 N--CA 1.496 1.869 0 CA-C-N 114.523 -1.217 . . . . 0.0 111.026 -179.695 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.1 m-85 -138.35 -54.73 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 114.368 -1.287 . . . . 0.0 108.559 179.831 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 9' ' ' GLU . 8.2 p -114.65 -128.98 0.3 Allowed 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 106.27 -1.752 . . . . 0.0 106.27 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.552 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 5.0 tm-20 -113.18 -43.82 3.33 Favored 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -179.84 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.548 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.418 ' H ' ' HG2' ' A' ' 11' ' ' ARG . 1.2 ptm180 -100.78 123.98 45.76 Favored 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 113.781 -1.554 . . . . 0.0 113.14 -179.6 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 49.5 m -132.57 162.61 30.83 Favored 'General case' 0 N--CA 1.501 2.087 0 CA-C-N 113.048 -1.887 . . . . 0.0 109.131 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -122.88 38.02 4.28 Favored 'General case' 0 N--CA 1.504 2.238 0 O-C-N 123.469 0.481 . . . . 0.0 110.889 179.898 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.404 ' O ' ' CB ' ' A' ' 15' ' ' SER . 64.7 t0 -141.55 -66.09 0.42 Allowed 'General case' 0 N--CA 1.501 2.112 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.689 179.881 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.404 ' CB ' ' O ' ' A' ' 14' ' ' ASP . 45.8 t 123.13 -60.33 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.881 2.072 . . . . 0.0 107.467 -179.933 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.3 p -36.39 -52.9 0.84 Allowed 'General case' 0 N--CA 1.506 2.341 0 CA-C-O 121.846 0.831 . . . . 0.0 112.47 179.748 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -64.06 -45.02 90.61 Favored 'General case' 0 N--CA 1.494 1.763 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.957 179.92 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.421 ' O ' ' HB3' ' A' ' 21' ' ' HIS . 36.4 tp -55.57 -40.09 71.52 Favored 'General case' 0 N--CA 1.501 2.093 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.883 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.53 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -59.17 -54.5 46.25 Favored 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 105.817 -1.92 . . . . 0.0 105.817 179.45 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 32.5 m -46.64 -55.29 7.92 Favored 'General case' 0 N--CA 1.509 2.479 0 N-CA-C 107.91 -1.144 . . . . 0.0 107.91 179.486 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.548 ' CG ' HD13 ' A' ' 10' ' ' ALC . 36.9 t60 -43.82 -56.78 3.63 Favored 'General case' 0 N--CA 1.499 1.999 0 CA-C-N 114.488 -1.233 . . . . 0.0 108.776 179.398 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.8 mt -53.0 -41.97 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 C-N-CA 119.433 -0.907 . . . . 0.0 110.09 179.7 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.462 ' HA ' ' HB2' ' A' ' 27' ' ' SER . 18.9 mmmt -91.26 18.03 7.55 Favored 'General case' 0 N--CA 1.495 1.823 0 N-CA-C 117.394 2.368 . . . . 0.0 117.394 -179.905 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.6 p -123.54 -37.61 2.63 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 106.456 -1.683 . . . . 0.0 106.456 178.718 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.546 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -104.35 -43.14 5.28 Favored 'General case' 0 N--CA 1.497 1.922 0 CA-C-N 115.184 -0.917 . . . . 0.0 109.943 179.919 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 59.1 m-70 -100.16 43.38 1.06 Allowed 'General case' 0 N--CA 1.503 2.179 0 C-N-CA 118.517 -1.273 . . . . 0.0 108.117 -179.999 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 23' ' ' LYS . 44.4 t -126.37 59.16 1.35 Allowed 'General case' 0 N--CA 1.495 1.792 0 CA-C-N 113.505 -1.68 . . . . 0.0 107.477 179.631 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -123.32 61.44 1.04 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.305 -179.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -120.85 -34.88 3.46 Favored 'General case' 0 N--CA 1.496 1.827 0 CA-C-N 113.481 -1.691 . . . . 0.0 109.189 179.824 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 56.4 tptt . . . . . 0 N--CA 1.495 1.8 0 CA-C-O 122.544 1.164 . . . . 0.0 108.153 -179.991 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 110.023 -0.362 . . . . 0.0 110.023 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 37.4 p -112.18 176.98 4.8 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.988 0.899 . . . . 0.0 109.244 179.859 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -110.23 132.87 53.79 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 112.929 -1.942 . . . . 0.0 105.76 179.898 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -114.9 142.23 46.87 Favored 'General case' 0 N--CA 1.493 1.696 0 N-CA-C 103.232 -2.877 . . . . 0.0 103.232 179.694 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 43.2 t -63.51 161.87 13.73 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 117.244 -1.782 . . . . 0.0 112.502 -179.893 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 68.0 mt-30 -108.79 20.83 18.02 Favored 'General case' 0 N--CA 1.499 2.012 0 CA-C-N 113.943 -1.48 . . . . 0.0 110.011 -179.704 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -138.57 -52.26 0.58 Allowed 'General case' 0 N--CA 1.497 1.91 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 179.801 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 13.8 p -115.87 -158.02 0.67 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 105.428 -2.064 . . . . 0.0 105.428 179.711 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -124.64 58.09 1.24 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 123.903 0.752 . . . . 0.0 109.041 179.91 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.428 ' HG ' ' H ' ' A' ' 11' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.428 ' H ' ' HG ' ' A' ' 10' ' ' ALC . 8.0 tpp85 -118.73 126.46 51.95 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 124.152 0.908 . . . . 0.0 110.737 -179.846 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -133.66 170.48 15.48 Favored 'General case' 0 N--CA 1.498 1.938 0 N-CA-C 106.633 -1.617 . . . . 0.0 106.633 179.379 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -114.75 -14.76 11.97 Favored 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.146 179.956 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -130.02 170.09 14.43 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 124.385 1.053 . . . . 0.0 112.253 -179.722 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 35.0 t -81.66 -63.04 1.47 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.57 -179.991 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.9 m -35.84 -51.35 0.69 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-O 122.317 1.056 . . . . 0.0 108.817 179.54 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -53.74 -59.06 5.11 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 113.077 -1.874 . . . . 0.0 111.889 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.9 tp -56.22 -37.99 70.43 Favored 'General case' 0 N--CA 1.498 1.954 0 C-N-CA 119.833 -0.747 . . . . 0.0 110.663 -179.733 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -60.4 -56.42 21.62 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.391 -1.336 . . . . 0.0 107.391 179.683 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 76.8 m -45.57 -50.63 12.93 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 179.412 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.405 ' CG ' HD13 ' A' ' 10' ' ' ALC . 32.5 t60 -52.02 -61.74 2.07 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 113.667 -1.606 . . . . 0.0 110.204 179.439 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.3 mt -48.77 -58.32 1.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 123.466 0.479 . . . . 0.0 111.252 -179.906 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -39.36 -40.91 0.86 Allowed 'General case' 0 N--CA 1.494 1.746 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -179.994 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 8.0 m -99.32 -41.05 7.62 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 117.213 2.301 . . . . 0.0 117.213 -179.355 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.0 mmtm -83.36 -16.85 44.46 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 115.527 1.677 . . . . 0.0 115.527 -179.509 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 61.9 m-70 -122.4 -38.12 2.71 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 123.376 0.422 . . . . 0.0 110.263 179.845 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 74.6 m -108.74 46.55 0.96 Allowed 'General case' 0 N--CA 1.495 1.82 0 CA-C-N 114.683 -1.144 . . . . 0.0 109.96 179.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -9.2 124.04 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 117.072 2.249 . . . . 0.0 117.072 179.831 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.564 ' H ' ' HA ' ' A' ' 30' ' ' LYS . 4.7 mm-40 -112.59 -53.75 2.68 Favored 'General case' 0 N--CA 1.5 2.047 0 CA-C-N 114.35 -1.295 . . . . 0.0 110.863 -179.988 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.564 ' HA ' ' H ' ' A' ' 29' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.502 2.147 0 CA-C-N 121.95 2.159 . . . . 0.0 111.19 -0.191 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.436 ' N ' ' HD2' ' A' ' 1' ' ' LYS . 1.5 mptp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -101.1 174.14 6.14 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 120.509 1.504 . . . . 0.0 109.39 0.043 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -118.33 141.51 48.46 Favored 'General case' 0 N--CA 1.5 2.025 0 N-CA-C 106.12 -1.807 . . . . 0.0 106.12 179.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -111.83 144.01 41.84 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 124.77 1.294 . . . . 0.0 111.569 -179.382 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.445 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 42.8 t -52.01 174.35 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 114.118 1.155 . . . . 0.0 114.118 179.798 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.445 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 36.8 tt0 -101.71 -29.0 12.16 Favored 'General case' 0 N--CA 1.498 1.93 0 CA-C-N 114.228 -1.351 . . . . 0.0 110.563 -179.919 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 63.0 m-85 -103.87 -43.54 5.28 Favored 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 114.14 1.163 . . . . 0.0 114.14 -179.562 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.3 p -112.52 -160.45 0.72 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 123.473 0.483 . . . . 0.0 110.832 -179.845 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -114.01 55.54 0.73 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 124.751 1.282 . . . . 0.0 109.697 179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.501 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.475 ' HD3' ' C ' ' A' ' 10' ' ' ALC . 0.0 OUTLIER -119.87 130.19 54.74 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 124.125 0.891 . . . . 0.0 109.872 179.727 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.5 m -125.65 174.53 8.21 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-N 114.142 -1.39 . . . . 0.0 108.812 179.74 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.7 -12.22 16.0 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 124.387 1.054 . . . . 0.0 110.736 -179.889 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -140.69 156.9 46.1 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.669 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 74.5 p -91.06 22.42 3.73 Favored 'General case' 0 N--CA 1.501 2.106 0 CA-C-O 122.445 1.117 . . . . 0.0 109.63 179.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.5 m -119.2 -39.27 2.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 102.519 -3.141 . . . . 0.0 102.519 179.639 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -70.52 -49.73 45.18 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 103.662 -2.718 . . . . 0.0 103.662 179.516 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.83 -34.41 62.81 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 179.424 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.45 -56.5 13.8 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.6 m -45.78 -51.5 12.61 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 179.328 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.501 ' CG ' HD13 ' A' ' 10' ' ' ALC . 24.8 t60 -47.89 -61.01 2.17 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.211 179.411 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 96.4 mt -47.25 -59.91 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.16 0 O-C-N 123.542 0.526 . . . . 0.0 111.554 179.862 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 42.1 mmtm -35.22 -43.82 0.24 Allowed 'General case' 0 N--CA 1.501 2.11 0 O-C-N 124.942 1.401 . . . . 0.0 114.727 179.967 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 89.0 m -102.61 -39.28 7.14 Favored 'General case' 0 N--CA 1.506 2.364 0 N-CA-C 118.106 2.632 . . . . 0.0 118.106 -179.518 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 47.7 mmtm -78.03 -25.19 47.73 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -179.376 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.407 ' O ' ' CB ' ' A' ' 27' ' ' SER . 78.1 m-70 -111.57 -46.0 3.31 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 123.71 0.631 . . . . 0.0 109.378 -179.877 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 26' ' ' HIS . 86.9 p 119.13 -177.26 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.277 0 O-C-N 126.807 2.567 . . . . 0.0 108.786 179.923 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 39.4 mttp 95.07 161.07 0.02 OUTLIER 'General case' 0 N--CA 1.504 2.246 0 O-C-N 126.552 2.408 . . . . 0.0 112.164 179.515 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -125.05 21.75 8.07 Favored 'General case' 0 N--CA 1.494 1.728 0 CA-C-N 113.635 -1.62 . . . . 0.0 109.184 179.974 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 9.5 mtpm? . . . . . 0 N--CA 1.496 1.869 0 CA-C-N 114.411 -1.268 . . . . 0.0 110.181 179.99 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.623 ' H2 ' ' HA ' ' A' ' 2' ' ' THR . 18.5 pttm . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 112.117 0.414 . . . . 0.0 112.117 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.623 ' HA ' ' H2 ' ' A' ' 1' ' ' LYS . 33.5 p -112.79 160.54 17.88 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 119.646 -1.909 . . . . 0.0 110.36 -0.055 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -120.87 151.45 39.63 Favored 'General case' 0 N--CA 1.495 1.789 0 CA-C-N 113.755 -1.566 . . . . 0.0 106.858 179.661 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.42 ' HA ' ' O ' ' A' ' 10' ' ' ALC . 3.9 mm100 -116.18 161.59 18.72 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 124.574 1.171 . . . . 0.0 110.32 179.984 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.421 ' SG ' ' N ' ' A' ' 6' ' ' GLN . 36.8 t -83.11 169.16 16.17 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.896 -1.122 . . . . 0.0 110.509 179.775 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.421 ' N ' ' SG ' ' A' ' 5' ' ' CYS . 27.3 mt-30 -92.43 -39.3 11.5 Favored 'General case' 0 N--CA 1.505 2.294 0 CA-C-N 114.642 -1.163 . . . . 0.0 113.371 -179.789 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 80.5 m-85 -82.32 -47.56 12.22 Favored 'General case' 0 N--CA 1.497 1.914 0 CA-C-N 115.508 -0.769 . . . . 0.0 109.955 -179.667 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 12.9 p -116.22 -162.93 0.87 Allowed 'General case' 0 N--CA 1.496 1.855 0 N-CA-C 107.645 -1.243 . . . . 0.0 107.645 179.827 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 45.6 tp10 -118.97 61.39 0.8 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-N 114.522 -1.217 . . . . 0.0 108.339 179.842 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.472 ' HB3' ' SG ' ' A' ' 8' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 13.6 ptt180 -110.03 128.59 55.51 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 124.419 1.074 . . . . 0.0 111.05 -179.658 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.2 m -131.53 173.75 10.79 Favored 'General case' 0 N--CA 1.5 2.025 0 CA-C-N 113.794 -1.548 . . . . 0.0 109.825 -179.966 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -115.45 -18.92 10.87 Favored 'General case' 0 N--CA 1.499 1.978 0 CA-C-N 114.569 -1.196 . . . . 0.0 109.742 179.936 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.484 ' CG ' ' H ' ' A' ' 15' ' ' SER . 29.3 t70 -116.25 -173.07 2.3 Favored 'General case' 0 N--CA 1.5 2.029 0 CA-C-N 114.287 -1.324 . . . . 0.0 111.271 -179.517 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.484 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 43.2 m -114.46 -53.95 2.62 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 123.846 0.716 . . . . 0.0 109.356 179.986 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.7 m -41.59 -49.86 4.09 Favored 'General case' 0 N--CA 1.509 2.477 0 CA-C-O 122.906 1.336 . . . . 0.0 108.592 179.6 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -57.76 -49.28 77.11 Favored 'General case' 0 N--CA 1.49 1.541 0 CA-C-N 113.094 -1.867 . . . . 0.0 110.91 179.646 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 15.7 tp -56.95 -39.12 73.96 Favored 'General case' 0 N--CA 1.501 2.114 0 C-N-CA 119.109 -1.036 . . . . 0.0 109.707 179.945 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -62.52 -59.05 5.5 Favored 'General case' 0 N--CA 1.499 2.016 0 C-N-CA 118.899 -1.12 . . . . 0.0 108.568 179.607 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 36.5 p -47.44 -45.96 26.24 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 108.367 -0.975 . . . . 0.0 108.367 179.754 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.408 ' CG ' HD13 ' A' ' 10' ' ' ALC . 51.5 t60 -52.61 -60.38 3.32 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 179.509 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 85.9 mt -47.67 -55.51 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.357 0 N-CA-C 112.793 0.664 . . . . 0.0 112.793 179.76 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -59.11 -22.05 60.22 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.817 1.784 . . . . 0.0 115.817 -179.826 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 85.0 m -108.65 -36.16 6.25 Favored 'General case' 0 N--CA 1.507 2.418 0 N-CA-C 116.323 1.972 . . . . 0.0 116.323 -179.508 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 14.1 mmmm -93.72 -25.1 17.59 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 115.314 1.598 . . . . 0.0 115.314 -179.435 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 75.3 m-70 -107.33 -55.39 2.35 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.212 -0.995 . . . . 0.0 112.748 -179.776 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 12.9 p 5.5 -76.46 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 O-C-N 125.515 1.76 . . . . 0.0 115.496 -179.662 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 20.5 pttm -32.66 -41.82 0.07 Allowed 'General case' 0 N--CA 1.504 2.241 0 N-CA-C 116.595 2.072 . . . . 0.0 116.595 179.599 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 6.71 71.64 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.502 0 O-C-N 125.717 1.885 . . . . 0.0 113.955 -179.632 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 41.0 ttmt . . . . . 0 N--CA 1.504 2.272 0 CA-C-N 113.437 -1.711 . . . . 0.0 115.514 -179.866 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.5 pttm . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 111.309 0.114 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 22.8 m -113.38 163.37 14.94 Favored 'General case' 0 N--CA 1.498 1.961 0 CA-C-O 121.9 0.857 . . . . 0.0 109.643 -179.912 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -136.1 92.12 2.76 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-N 113.323 -1.762 . . . . 0.0 108.859 -179.895 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 4.4 tm0? -103.33 126.36 50.45 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 179.997 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 35.1 t -34.07 154.05 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.067 0 N-CA-C 117.655 2.465 . . . . 0.0 117.655 -179.745 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -106.78 19.39 20.55 Favored 'General case' 0 N--CA 1.506 2.332 0 CA-C-N 114.842 -1.072 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.456 ' HB2' ' CD2' ' A' ' 26' ' ' HIS . 75.3 m-85 -135.32 -53.21 0.78 Allowed 'General case' 0 N--CA 1.495 1.8 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.778 179.969 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.425 ' SG ' ' HB3' ' A' ' 10' ' ' ALC . 11.7 p -114.18 -159.84 0.71 Allowed 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 114.558 -1.201 . . . . 0.0 109.999 -179.705 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -108.67 52.33 0.72 Allowed 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.738 -179.815 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ALC . . . . . 0.429 HD13 ' CG ' ' A' ' 21' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -123.69 115.02 20.75 Favored 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 115.403 1.631 . . . . 0.0 115.403 -179.44 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.3 m -126.9 164.0 22.41 Favored 'General case' 0 N--CA 1.498 1.955 0 N-CA-C 107.583 -1.266 . . . . 0.0 107.583 179.386 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -134.22 36.6 3.21 Favored 'General case' 0 N--CA 1.502 2.166 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 179.823 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -133.77 -66.85 0.62 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-N 114.835 -1.075 . . . . 0.0 112.6 -179.777 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 58.7 m 123.44 -63.71 0.0 OUTLIER 'General case' 0 N--CA 1.509 2.499 0 O-C-N 126.558 2.411 . . . . 0.0 109.879 -179.851 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 20.1 m -38.55 -48.73 1.45 Allowed 'General case' 0 N--CA 1.512 2.642 0 CA-C-O 122.644 1.211 . . . . 0.0 111.885 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -67.35 -48.64 66.9 Favored 'General case' 0 N--CA 1.492 1.662 0 CA-C-N 113.899 -1.501 . . . . 0.0 110.635 179.794 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.1 tp -55.25 -44.69 75.76 Favored 'General case' 0 N--CA 1.502 2.125 0 CA-C-O 121.37 0.605 . . . . 0.0 109.551 -179.924 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.402 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 4.2 ttpm? -53.44 -61.37 2.34 Favored 'General case' 0 N--CA 1.495 1.782 0 N-CA-C 107.205 -1.406 . . . . 0.0 107.205 179.58 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 94.0 m -45.02 -53.59 7.6 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 124.591 1.182 . . . . 0.0 108.502 179.552 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.429 ' CG ' HD13 ' A' ' 10' ' ' ALC . 14.6 t60 -47.95 -53.49 15.83 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 124.288 0.992 . . . . 0.0 109.725 179.563 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 94.8 mt -57.46 -59.61 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.78 0 C-N-CA 119.849 -0.74 . . . . 0.0 109.704 179.949 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -41.21 -27.14 0.07 Allowed 'General case' 0 N--CA 1.497 1.907 0 N-CA-C 115.399 1.629 . . . . 0.0 115.399 -179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 7.4 t -105.64 -38.86 6.27 Favored 'General case' 0 N--CA 1.501 2.094 0 N-CA-C 114.912 1.449 . . . . 0.0 114.912 179.984 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -93.89 -13.62 26.96 Favored 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.456 ' CD2' ' HB2' ' A' ' 7' ' ' TYR . 45.7 m-70 -119.73 -28.67 5.2 Favored 'General case' 0 N--CA 1.496 1.846 0 N-CA-C 107.116 -1.439 . . . . 0.0 107.116 179.794 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 57.8 p 24.31 76.61 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.169 0 N-CA-C 117.656 2.465 . . . . 0.0 117.656 179.644 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -7.2 -77.71 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.251 0 N-CA-C 116.674 2.101 . . . . 0.0 116.674 179.894 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -128.98 53.5 1.87 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 124.306 1.004 . . . . 0.0 111.245 -179.885 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 53.4 mttm . . . . . 0 N--CA 1.51 2.536 0 N-CA-C 116.813 2.153 . . . . 0.0 116.813 179.641 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_